-
4-[(2E)-3,7-dimethylocta-2,6-dienoxy]furo[3,2-g]chromen-7-one Molecule
InChIKey DBMJZOMNXBSRED-OQLLNIDSSA-N
Related Dataset(s)
- SI_Outreach_4_2D_1st_column_lime_extract_06012024_FULL[5]
- SI_Outreach_4_2D_1st_column_lime_extract_06012024_FULL[2]
- SI_Outreach_4_2F_B_2nd_column_lime_05312024_FULL[6]
- SI_Outreach_4_2F_column_lime_05302024[1]
- SI_Outreach_4_2F_B_2nd_column_lime_05312024_FULL[4]
- SI_Outreach_4_2D_column_lime_05302024[3]
- SI_Outreach_4_2F_B_2nd_column_lime_05312024[1]
- SI_Outreach_4_2D_column_lime_05302024[6]
- SI_Outreach_4_2F_B_2nd_column_lime_05312024_FULL[1]
- SI_Outreach_4_2D_column_lime_05302024[2]
- SI_Outreach_4_2D_column_lime_05302024[1]
- BERGAMOTTIN_FULL_NMR_THIX-029C2_2nd_col_4_1_Hex_EA_lime_peels_extract_06082024[6]
- SI_Outreach_4_2D_1st_column_lime_extract_06012024_FULL[6]
- BERGAMOTTIN_FULL_NMR_THIX-029C2_2nd_col_4_1_Hex_EA_lime_peels_extract_06082024[5]
- SI_Outreach_4_2F_B_2nd_column_lime_05312024_FULL[5]
- SI_Outreach_4_2D_1st_column_lime_extract_06012024_FULL[3]
- BERGAMOTTIN_FULL_NMR_THIX-029C2_2nd_col_4_1_Hex_EA_lime_peels_extract_06082024[3]
- SI_Outreach_4_2D_1st_column_lime_extract_06012024_FULL[7]
- SI_Outreach_4_2D_1st_column_lime_extract_06012024_FULL[4]
- SI_Outreach_4_2F_B_2nd_column_lime_05312024_FULL[2]
- SI_Outreach_4_2F_B_2nd_column_lime_05312024_FULL[3]
- SI_Outreach_4_2D_column_lime_05302024[4]
- SI_Outreach_5_1A_grapefruit_meat_05_31_2024[1]
- SI_Outreach_4_2D_column_lime_05302024.cosy
- SI_Outreach_4_4A_graprefruit_peels_05312024[1]
- BERGAMOTTIN_FULL_NMR_THIX-029C2_2nd_col_4_1_Hex_EA_lime_peels_extract_06082024[1]
- BERGAMOTTIN_FULL_NMR_THIX-029C2_2nd_col_4_1_Hex_EA_lime_peels_extract_06082024[4]
-
4-[(E)-2-hydroxy-16-(2-hydroxy-3-methyl-5-oxo-2H-furan-4-yl)-5-methyl-4,16-di... Molecule
InChIKey SYADJZZKJSIWKK-PKNBQFBNSA-N Molecular Formula C27H39NO8
Related Dataset(s)
-
4-amino-1-[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one Molecule
InChIKey UHDGCWIWMRVCDJ-UHFFFAOYSA-N
Related Dataset(s)
- GP 1-Cytidine[2]
- Cytidine,cell culture tested, Cyd, 1-beta-D-Ribofuranoside cytosine, rC, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine beta-D-riboside; LC-ESI-QQ; MS2
- Cytidine; LC-ESI-QTOF; MS2; CE 40 ev; [M+H]+
- Cytidine; LC-ESI-QTOF; MS2; 120 V
- Cytidine; LC-ESI-QTOF; MS2; 110 V
- Cytidine,cell culture tested, Cyd, 1-beta-D-Ribofuranoside cytosine, rC, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine beta-D-riboside; LC-ESI-QQ; MS2
- Cytidine,cell culture tested, Cyd, 1-beta-D-Ribofuranoside cytosine, rC, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine beta-D-riboside; LC-ESI-QQ; MS2
- Cytidine; LC-ESI-QTOF; MS; POSITIVE
- Cytidine,cell culture tested, Cyd, 1-beta-D-Ribofuranoside cytosine, rC, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine beta-D-riboside; LC-ESI-QQ; MS2
- Cytidine; LC-APCI-QTOF; MS; NEGATIVE
- Cytidine; LC-ESI-QTOF; MS2; 130 V
- Cytidine; LC-ESI-QTOF; MS2; 40 V
- Cytidine; LC-ESI-QTOF; MS2; 50 V
- Cytidine; LC-ESI-QTOF; MS; NEGATIVE
- Cytidine,cell culture tested, Cyd, 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one, 1-beta-D-Ribofuranoside cytosine, rC, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine beta-D-riboside; LC-ESI-QTOF; MS2
- Cytidine,cell culture tested, Cyd, 1-beta-D-Ribofuranoside cytosine, rC, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine beta-D-riboside; LC-ESI-QQ; MS2
- Cytidine; LC-ESI-QTOF; MS2; 30 V
- Cytidine; LC-ESI-QTOF; MS2; 80 V
- Cytidine,cell culture tested, Cyd, 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one, 1-beta-D-Ribofuranoside cytosine, rC, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine beta-D-riboside; LC-ESI-QTOF; MS2
- GP 1-Cytidine[1]
- Cytidine; LC-ESI-QTOF; MS2; 90 V
- Cytidine; LC-ESI-QTOF; MS2; 40 V
- Cytidine; LC-ESI-QTOF; MS2; 70 V
- Cytidine,cell culture tested, Cyd, 1-beta-D-Ribofuranoside cytosine, rC, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine beta-D-riboside; LC-ESI-QQ; MS2
- Cytidine; LC-ESI-QTOF; MS2; CE 20 ev; [M+H]+
- Cytidine; LC-ESI-QTOF; MS2; 60 V
- Cytidine,cell culture tested, Cyd, 4-amino-1-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]pyrimidin-2-one, 1-beta-D-Ribofuranoside cytosine, rC, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine beta-D-riboside; LC-ESI-QTOF; MS2
- Cytidine; LC-ESI-QTOF; MS2; CE 10 ev; [M-H]-
- Cytidine; LC-ESI-QTOF; MS2; 10 V
- Cytidine; LC-APCI-QTOF; MS; POSITIVE
- Cytidine; LC-ESI-QTOF; MS2; CE 10 ev; [M+H]+
- Cytidine; LC-ESI-QTOF; MS2; 100 V
- Cytidine; LC-ESI-QTOF; MS2; 20 V
- Cytidine,cell culture tested, Cyd, 1-beta-D-Ribofuranoside cytosine, rC, 4-Amino-1-beta-D-ribofuranosyl-2(1H)-pyrimidinone, Cytosine beta-D-riboside; LC-ESI-QQ; MS2
-
4-ethenylbenzenesulfonic acid Molecule
InChIKey MAGFQRLKWCCTQJ-UHFFFAOYSA-N
Related Dataset(s)
- PS 2-2120 Da[2]
- PS 1-1100 Da[1]
- PS 1-1100 Da[2]
- PS 4-9680 Da[2]
- PS 3-4230 Da.
- PS 5-29100 Da[1]
- PS 5-29100 Da[2]
- PS 4-9680 Da.noesy
- PS 3-4230 Da.noesy
- 4-Ethenylbenzenesulfonic acid; ESI-QTOF; MS2; CE: 10; [M-H]-
- PS 2-2120 Da.noesy
- 4-Ethenylbenzenesulfonic acid; ESI-QTOF; MS2; CE: 20; [M-H]-
- 4-Ethenylbenzenesulfonic acid; ESI-QTOF; MS2; CE: 40; [M-H]-
-
4a,8,8-trimethyl-3-methylidene-4-(3-methylpenta-2,4-dienyl)-2,4,5,6,7,8a-hexa... Molecule
InChIKey UITXFWAOWQMNFN-UHFFFAOYSA-N Molecular Formula C20H32O
Related Dataset(s)
-
5,7,11,19-tetraoxapentacyclo[10.8.0.02,10.04,8.013,18]icosa-2,4(8),9,13(18),1... Molecule
InChIKey GLMPLZUBQDAZEN-UHFFFAOYSA-N Molecular Formula C16H12O6
Related Dataset(s)
- YAC_1Z (Compound 11) 6alpha-Hydroxymaackiain.
- YAC_1Z (Compound 11) 6alpha-Hydroxymaackiain[15]
- YAC_1Z (Compound 11) 6alpha-Hydroxymaackiain[13]
- YAC_1Z (Compound 11) 6alpha-Hydroxymaackiain[14]
- YAC_1Z (Compound 11) 6alpha-Hydroxymaackiain[12]
- YAC_1Z (Compound 11) 6alpha-Hydroxymaackiain.1d
- YAC_1Z (Compound 11) 6alpha-Hydroxymaackiain[16]
- YAC_1Z (Compound 11) 6alpha-Hydroxymaackiain[17]
-
5,7-dimethoxy-8-(3-methylbut-2-enyl)-2-phenyl-3,4-dihydro-2H-chromen-4-ol Molecule
InChIKey ADIMMCHZVYYGPW-UHFFFAOYSA-N Molecular Formula C22H26O4
Related Dataset(s)
- YAC_3D (Compound 21) Tephrowatsin A[16]
- YAC_3D (Compound 21) Tephrowatsin A.cosy
- YAC_3D (Compound 21) Tephrowatsin A[11]
- YAC_3D (Compound 21) Tephrowatsin A.
- YAC_3D (Compound 21) Tephrowatsin A.tocsy
- YAC_3D (Compound 21) Tephrowatsin A.noesy
- YAC_3D (Compound 21) Tephrowatsin A[17]
- YAC_3D (Compound 21) Tephrowatsin A[12]
-
5-[[3,4-dihydroxy-6-(hydroxymethyl)-5-[[3,4,5-trihydroxy-6-(methoxymethyl)oxa... Molecule
InChIKey ZYEIDZAYGZWEBD-UHFFFAOYSA-N
Related Dataset(s)
-
5-hydroxy-3-(4-hydroxyphenyl)-8-(2-hydroxypropan-2-yl)-8,9-dihydrofuro[2,3-h]... Molecule
InChIKey GAYGJVDTHPROFS-UHFFFAOYSA-N Molecular Formula C20H18O6
Related Dataset(s)
-
5-hydroxy-7-methoxy-8-(3-methylbut-2-enyl)-2-phenyl-2,3-dihydrochromen-4-one Molecule
InChIKey NISHDQWTPMJBJI-UHFFFAOYSA-N Molecular Formula C21H22O4
Related Dataset(s)
-
6-(hydroxymethyl)oxane-2,3,4,5-tetrol Molecule
InChIKey WQZGKKKJIJFFOK-UHFFFAOYSA-N Molecular Formula C6H12O6
Related Dataset(s)
- D-(+)-Galactose, Gal, Brain sugar, Cerebrose, D-Galactopyranose; LC-ESI-QQ; MS2
- Outreach_2_3_glucose_standard_D2O_05312024[1]
- 492-62-6[1h.fid.dx]
- 492-62-6[hmbc.dx]
- 492-62-6[13c.dx]
- Isobar: glucose,fructose,mannose,galactose; LC-ESI-IT; MS2; m/z: 179.2; [M-H]-
- D-Mannopyranose, D-Seminose, D-(+)-Mannose,from wood, Man, Carubinose; LC-ESI-QQ; MS2
- SI_Outreach_2_3_glucose_standard_D2O_05312024[1]
- 492-62-6.cosy
- 492-62-6[1h.dx]
- 492-62-6[hsqced.ser.dx]
- 492-62-6.hmbc
- beta-D-Glucopyranose, beta-D(+)Glucose, beta-Glc; LC-ESI-QQ; MS2
- 492-62-6[13c.fid.dx]
- 492-62-6[cosy.dx]
- 492-62-6[noesy.ser.dx]
- 492-62-6[noesy.dx]
- 492-62-6[hsqced.dx]
-
7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one Molecule
InChIKey ANJTVLIZGCUXLD-UHFFFAOYSA-N Molecular Formula C11H14N2O
Related Dataset(s)
- 485-35-8[13c.dx]
- 485-35-8[1h.fid.dx]
- 485-35-8.hmbc
- 485-35-8[hmbc.ser.dx]
- 485-35-8[dept135.dx]
- 485-35-8.deptq
- 485-35-8.noesy
- 485-35-8[dept90.fid.dx]
- 485-35-8[13c.fid.dx]
- 485-35-8[cosy.ser.dx]
- 485-35-8.deptq
- 485-35-8[1h.dx]
- 485-35-8[cosy.dx]
- 485-35-8.hsqc
- 485-35-8[hnHMQC.ser.dx]
- 485-35-8.dept
- 485-35-8[dept45.dx]
- 485-35-8[dept135.fid.dx]
- 485-35-8.dept
- 485-35-8.hmqc
- 485-35-8.hsqc
- 485-35-8.noesy
-
N-[4,5-dihydroxy-6-(hydroxymethyl)-2-(4,5,6-trihydroxy-2-methyloxan-3-yl)oxyo... Molecule
InChIKey AAXKQQFZVKGBOL-UHFFFAOYSA-N
Related Dataset(s)
- HMWDOM 915m F11[2]
- HMWDOM 15m F01[1]
- HMWDOM 15m F10[1]
- HMWDOM 15m F04[2]
- HMWDOM 15m F09[1]
- HMWDOM 15m F05[2]
- HMWDOM 915m F05[1]
- HMWDOM 15m F07[1]
- HMWDOM 915m F10[2]
- HMWDOM 15m F03[2]
- HMWDOM 915m Whole[2]
- HMWDOM 15m F08[2]
- HMWDOM 15m F08[1]
- HMWDOM 915m F10[1]
- HMWDOM 915m F07[2]
- HMWDOM 15m F03[1]
- HMWDOM 915m F08[1]
- HMWDOM 915m F06[2]
- HMWDOM 915m F02[2]
- HMWDOM 15m F01[2]
- HMWDOM 915m F08[2]
- HMWDOM 15m Whole[1]
- HMWDOM 915m Whole[1]
- HMWDOM 15m F11[1]
- HMWDOM 15m F09[2]
- HMWDOM 915m F01[1]
- HMWDOM 915m F06[1]
- HMWDOM 15m F06[1]
- HMWDOM 15m Whole[2]
- HMWDOM 915m F03[2]
- HMWDOM 915m F02[1]
- HMWDOM 915m F11[1]
- HMWDOM 15m F02[2]
- HMWDOM 915m F09[1]
- HMWDOM 915m F04[1]
- HMWDOM 15m F04.noesy
- HMWDOM 915m F04[2]
- HMWDOM 15m F02[1]
- HMWDOM 628m Whole[2]
- HMWDOM 915m F05[2]
- HMWDOM 915m F09[2]
- HMWDOM 15m F07[2]
- HMWDOM 15m F05[1]
- HMWDOM 915m F03[1]
- HMWDOM 15m F11[2]
- HMWDOM 915m F01[2]
- HMWDOM 628m Whole[1]
- HMWDOM 915m F07[1]
- HMWDOM 15m F06[2]
- HMWDOM 15m F10[2]
-
[17-acetyloxy-10-(hydroxymethyl)-13-methyl-2,3,4,7,8,9,11,12,14,15,16,17-dode... Molecule
InChIKey VQQAAFHOPRDUNW-UHFFFAOYSA-N
Related Dataset(s)
- 9_SODXX_163_FULL_C19_OH_C3_C17_DI_OAc_07_12_2021-CP9[5]
- 9_SODXX_163_FULL_C19_OH_C3_C17_DI_OAc_07_12_2021-CP9[4]
- 9_SODXX_163_FULL_C19_OH_C3_C17_DI_OAc_07_12_2021-CP9[3]
- 9_SODXX_163_FULL_C19_OH_C3_C17_DI_OAc_07_12_2021-CP9.hsqc
- 9_SODXX_163_FULL_C19_OH_C3_C17_DI_OAc_07_12_2021-CP9.noesy
- 9_SODXX_163_FULL_C19_OH_C3_C17_DI_OAc_07_12_2021-CP9.hmbc
- 9_SODXX_163_FULL_C19_OH_C3_C17_DI_OAc_07_12_2021-CP9[1]
- 9_SODXX_163_FULL_C19_OH_C3_C17_DI_OAc_07_12_2021-CP9[2]
-
ethane Molecule
InChIKey OTMSDBZUPAUEDD-UHFFFAOYSA-N
Related Dataset(s)
- SI_Outreach_4_2F_D_2nd_column_lime_05312024[1]
- SI_Outreach_5_3A_lime_meat_05312024[1]
- 3-1A_Figure_1C_red_cabbage_crude_d6_DMSO_05302024[1]
- SI_Outreach_4_2G_column_lime_05302024[1]
- 4-1A_Figure_1D_lemon_crude_05292024[2]
- 1-1A_Figure_1A_coffee_crude_05292024[1]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[20]
- SI_Outreach_4_2C_column_lime_05302024[1]
- Outreach_std_linoleic_acid_05312024[1]
- SI_Outreach_4_2L_colum_lime_05302024[1]
- 4-2A_Figure_2D_lime_crude_05292024[6]
- 1-1A_Figure_1A_coffee_crude_05292024[3]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[17]
- SI_Outreach_4_2F_B_2nd_colum_lime_06012024_FULL[1]
- 3-3A_Figure_3C_carrots_crude_05292024[1]
- SI_Outreach_3_1A_red_cabbage_extract_05_30_2024[1]
- 2-1A_Figure_1B_spinach_crude_05292024[1]
- SI_Outreach_4_2F_B_2nd_colum_lime_06012024_FULL[5]
- SI_Outreach_4_2F_B_2nd_colum_lime_06012024_FULL[3]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[18]
- 4-1A_Figure_1D_lemon_crude_05292024[1]
- 2-3A_Figure_3B_blueberries_crude_CDCl3_05302024[1]
- 1-2A_Figure_2A_black_tea_crude_05292024.
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[21]
- Outreach_4_2F_column_lime_05312024_300[1]
- Outreach_1_A1_23.3mg_coffee_0.5mL_d6_DMSO_06_04_2024[1]
- SI_Outreach_4_2E_column_lime_05302024[1]
- SI_Outreach_3_1A_red_cabbage_extract_AcOH_05_30_2024[1]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[15]
- SI_Outreach_4_2F_B_2nd_colum_lime_06012024_FULL[4]
- Outreach_4_2F_column_lime_05312024_300[3]
- 3-1A_Figure_1C_red_cabbage_crude_CDCl3_05302024[1]
- 4-2A_Figure_2D_lime_crude_05292024[1]
- SI_Outreach_5_2A_lemon_meat_05312024[1]
- 4-3A_Figure_3D_orange_crude_05292024[1]
- SI_Outreach_4_2B_column_lime_05302024[1]
- 1-3A_Figure_3A_green_tea_crude_05292024[1]
- 1-1A_Figure_1A_coffee_crude_05292024[2]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[19]
- 2-2A_Figure_2B_leaves_Mountain_Laurel_tree_crude_05292024[1]
- SI_Outreach_4_2K_column_lime_05_30_2024[1]
- 4-2A_Figure_2D_lime_crude_05292024[7]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[16]
- Outreach_4_2F_column_lime_05312024_300[2]
- 3-2A_Figure_2C_tomato_crude_05292024[1]
- Outreach_4_2K_column_lime_05_30_2024[1]
- SI_Outreach_4_2J_colum_lime_05302024[1]
- ETHANE; EI-B; MS
- 4-1A_Figure_1D_lemon_crude_05292024[3]
- 2-3A_Figure_3B_blueberry_crude_d6_DMSO_05302024[1]
- SI_Outreach_4_2F_B_2nd_colum_lime_06012024_FULL[6]
-
ethyl (2S)-2-acetamido-3-(1H-indol-3-yl)propanoate Molecule
InChIKey KQGQONPKSKUHHT-AWEZNQCLSA-N Molecular Formula C15H18N2O3
Related Dataset(s)
-
ethyl (E)-but-2-enoate Molecule
InChIKey ZFDIRQKJPRINOQ-HWKANZROSA-N Molecular Formula C6H10O2
Related Dataset(s)
- ETHYL CROTONATE; EI-B; MS
- Propyl ethoxy ethyl Des Br[3]
- Jena_623-70-1_light[6]
- Jena_623-70-1_light.proton
- CROTONIC ACID ETHYL ESTER; EI-B; MS
- Jena_623-70-1_light[2]
- Propyl ethoxy ethyl Des Br[4]
- Propyl ethoxy ethyl Des Br[6]
- Jena_623-70-1_light.hmbc
- CROTONIC ACID ETHYL ESTER; CI-B; MS
- Propyl ethoxy ethyl Des Br[1]
- Propyl ethoxy ethyl Des Br[5]
- Jena_623-70-1_light[4]
- ETHYL CROTONATE; EI-B; MS
- CROTONIC ACID ETHYL ESTER; EI-B; MS
- Propyl ethoxy ethyl Des Br[2]
- CROTONIC ACID ETHYL ESTER; EI-B; MS
- Jena_623-70-1_light[5]
