-
butyl prop-2-enoate Molecule
InChIKey CQEYYJKEWSMYFG-UHFFFAOYSA-N Molecular Formula C7H12O2
Related Dataset(s)
- N-BUTYL ACRYLATE; EI-B; MS
- 141-32-2[13c.dx]
- BUTYL ACRYLATE; EI-B; MS
- 141-32-2[13c.fid.dx]
- butyl acrylate.cosy
- butyl acrylate.1d
- 141-32-2[1Hnoesypr.fid.dx]
- 141-32-2[13c-gd.fid.dx]
- 141-32-2[1h.dx]
- 141-32-2[cosy.ser.dx]
- BUTYL ACRYLATE; EI-B; MS
- 141-32-2[hsqced.ser.dx]
- BUTYL ACRYLATE; CI-B; MS
- butyl acrylate.1d
- 141-32-2[1h.fid.dx]
- 141-32-2[cosy.dx]
- 141-32-2[13c-gd.dx]
- butyl acrylate.hsqc
- 141-32-2[1h-noesypr.dx]
- 141-32-2[hsqced.dx]
-
decane-1,10-diol Molecule
InChIKey FOTKYAAJKYLFFN-UHFFFAOYSA-N Molecular Formula C10H22O2
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1,10-DECANEDIOL; EI-B; MS
- 1,10-DECANEDIOL; EI-B; MS
- distortionless enhancement with polarization transfer (DEPT)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- correlation spectroscopy (COSY)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1,10-DECANEDIOL; EI-B; MS
-
dibenzofuran Molecule
InChIKey TXCDCPKCNAJMEE-UHFFFAOYSA-N Molecular Formula C12H8O
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- DIBENZOFURAN; EI-B; MS
- 1H--1H correlation spectroscopy (1H-1H COSY)
- DIBENZOFURAN; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- DIBENZOFURAN; EI-B; MS
-
diethoxymethoxyethane Molecule
InChIKey GKASDNZWUGIAMG-UHFFFAOYSA-N Molecular Formula C7H16O3
Related Dataset(s)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- TRIETHYL ORTHOFORMATE; EI-B; MS
- TRIETHYL ORTHOFORMATE; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- TRIETHYL ORTHOFORMATE; CI-B; MS
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
-
diethyl (E)-but-2-enedioate Molecule
InChIKey IEPRKVQEAMIZSS-AATRIKPKSA-N Molecular Formula C8H12O4
Related Dataset(s)
- DIETHYL FUMARATE; EI-B; MS
- 1H--1H correlation spectroscopy (1H-1H COSY)
- DIETHYL FUMARATE; EI-B; MS
- DIETHYL FUMARATE; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- FUMARIC ACID DIETHYL ESTER; EI-B; MS
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- DIETHYL FUMARATE; EI-B; MS
-
diethyl 2-propan-2-ylpropanedioate Molecule
InChIKey BYQFBFWERHXONI-UHFFFAOYSA-N Molecular Formula C10H18O4
Related Dataset(s)
- heteronuclear multiple bond coherence (HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- distortionless enhancement with polarization transfer (DEPT)
- heteronuclear single quantum coherence (HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- correlation spectroscopy (COSY)
- heteronuclear multiple bond coherence (HMBC)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- distortionless enhancement with polarization transfer (DEPT)
- DIETHYL ISOPROPYLMALONATE; EI-B; MS
- distortionless enhancement with polarization transfer (DEPT)
- correlation spectroscopy (COSY)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
-
diethyl benzene-1,4-dicarboxylate Molecule
InChIKey ONIHPYYWNBVMID-UHFFFAOYSA-N Molecular Formula C12H14O4
Related Dataset(s)
-
dimethoxymethylbenzene Molecule
InChIKey HEVMDQBCAHEHDY-UHFFFAOYSA-N Molecular Formula C9H12O2
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- BENZALDEHYDE DIMETHYL ACETAL; EI-B; MS
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- BENZALDEHYDE DIMETHYL ACETAL; EI-B; MS
- ALPHA,ALPHA-DIMETHOXYTOLUENE; EI-B; MS
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
-
dimethyl benzene-1,3-dicarboxylate Molecule
InChIKey VNGOYPQMJFJDLV-UHFFFAOYSA-N Molecular Formula C10H10O4
Related Dataset(s)
- DIMETHYL ISOPHTHALATE; EI-B; MS
- DIMETHYL ISOPHTHALATE; EI-B; MS
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1,3-DIMETHYL PHTHALAE; EI-B; MS
- DIMETHYL ISOPHTHALATE; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
-
dimethyl butanedioate Molecule
InChIKey MUXOBHXGJLMRAB-UHFFFAOYSA-N Molecular Formula C6H10O4
Related Dataset(s)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- DIMETHYL SUCCINATE; CI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- DIMETHYL SUCCINATE; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- BUTANEDIOIC ACID DIMETHYL ESTER; EI-B; MS
- DIMETHYL SUCCINATE; EI-B; MS
- DIMETHYL SUCCINATE; EI-B; MS
- DIMETHYL SUCCINATE; EI-B; MS
-
dodecanenitrile Molecule
InChIKey VXCUURYYWGCLIH-UHFFFAOYSA-N Molecular Formula C12H23N
Related Dataset(s)
-
ethane Molecule
InChIKey OTMSDBZUPAUEDD-UHFFFAOYSA-N
Related Dataset(s)
- 4-1A_Figure_1D_lemon_crude_05292024[2]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[18]
- SI_Outreach_3_1A_red_cabbage_extract_05_30_2024[1]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[20]
- SI_Outreach_4_2G_column_lime_05302024[1]
- 1-1A_Figure_1A_coffee_crude_05292024[3]
- 2-1A_Figure_1B_spinach_crude_05292024[1]
- 4-2A_Figure_2D_lime_crude_05292024[1]
- SI_Outreach_4_2F_B_2nd_colum_lime_06012024_FULL[3]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[15]
- SI_Outreach_4_2B_column_lime_05302024[1]
- Outreach_std_linoleic_acid_05312024[1]
- 3-1A_Figure_1C_red_cabbage_crude_CDCl3_05302024[1]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[16]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[19]
- 4-3A_Figure_3D_orange_crude_05292024[1]
- 4-2A_Figure_2D_lime_crude_05292024[7]
- Outreach_4_2F_column_lime_05312024_300[2]
- SI_Outreach_4_2J_colum_lime_05302024[1]
- SI_Outreach_4_2F_B_2nd_colum_lime_06012024_FULL[1]
- SI_Outreach_5_2A_lemon_meat_05312024[1]
- SI_Outreach_4_2C_column_lime_05302024[1]
- 2-3A_Figure_3B_blueberry_crude_d6_DMSO_05302024[1]
- 4-2A_Figure_2D_lime_crude_05292024[6]
- 1-2A_Figure_2A_black_tea_crude_05292024[1]
- SI_Outreach_4_2F_B_2nd_colum_lime_06012024_FULL[6]
- SI_Outreach_4_2F_B_2nd_colum_lime_06012024_FULL[4]
- 1-3A_Figure_3A_green_tea_crude_05292024[1]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[21]
- 1-1A_Figure_1A_coffee_crude_05292024[2]
- SI_Outreach_4_2F_B_2nd_colum_lime_06012024_FULL[5]
- 4-1A_Figure_1D_lemon_crude_05292024[1]
- 3-2A_Figure_2C_tomato_crude_05292024[1]
- Outreach_1_A1_23.3mg_coffee_0.5mL_d6_DMSO_06_04_2024[1]
- SI_Outreach_4_2L_colum_lime_05302024[1]
- Outreach_4_2K_column_lime_05_30_2024[1]
- LIME_COUMARIN_THIX-029C4B_3rd_col_mystery_cmpd_lime_peels_extract_06102024_FULL[17]
- Outreach_4_2F_column_lime_05312024_300[1]
- 1-1A_Figure_1A_coffee_crude_05292024[1]
- 2-2A_Figure_2B_leaves_Mountain_Laurel_tree_crude_05292024[1]
- SI_Outreach_3_1A_red_cabbage_extract_AcOH_05_30_2024[1]
- 2-3A_Figure_3B_blueberries_crude_CDCl3_05302024[1]
- SI_Outreach_4_2F_D_2nd_column_lime_05312024[1]
- SI_Outreach_4_2E_column_lime_05302024[1]
- 3-1A_Figure_1C_red_cabbage_crude_d6_DMSO_05302024[1]
- 3-3A_Figure_3C_carrots_crude_05292024[1]
- ETHANE; EI-B; MS
- SI_Outreach_4_2K_column_lime_05_30_2024[1]
- Outreach_4_2F_column_lime_05312024_300[3]
- 4-1A_Figure_1D_lemon_crude_05292024[3]
- SI_Outreach_5_3A_lime_meat_05312024[1]
-
ethyl (E)-3-phenylprop-2-enoate Molecule
InChIKey KBEBGUQPQBELIU-CMDGGOBGSA-N Molecular Formula C11H12O2
Related Dataset(s)
- CINNAMIC ACID ETHYL ESTER; EI-B; MS
- Ethyl cinnamate, 103-36-6[6]
- ETHYL CINNAMATE; EI-B; MS
- Ethyl cinnamate, 103-36-6[1]
- ETHYL 3-PHENYL-2-PROPENOATE; EI-B; MS
- ETHYL CINNAMATE; EI-B; MS
- ETHYL 3-PHENYL-2-PROPENOATE; CI-B; MS
- ETHYL CINNAMATE; EI-B; MS
- Ethyl cinnamate, 103-36-6[3]
- Ethyl cinnamate, 103-36-6[10]
- Ethyl cinnamate, 103-36-6[4]
- Ethyl cinnamate, 103-36-6[5]
- Ethyl cinnamate, 103-36-6[2]
-
ethyl (E)-but-2-enoate Molecule
InChIKey ZFDIRQKJPRINOQ-HWKANZROSA-N Molecular Formula C6H10O2
Related Dataset(s)
- CROTONIC ACID ETHYL ESTER; CI-B; MS
- Jena_623-70-1_light[4]
- Jena_623-70-1_light[6]
- CROTONIC ACID ETHYL ESTER; EI-B; MS
- Propyl ethoxy ethyl Des Br[6]
- ETHYL CROTONATE; EI-B; MS
- Propyl ethoxy ethyl Des Br[5]
- Propyl ethoxy ethyl Des Br[1]
- Propyl ethoxy ethyl Des Br[4]
- ETHYL CROTONATE; EI-B; MS
- Propyl ethoxy ethyl Des Br[3]
- CROTONIC ACID ETHYL ESTER; EI-B; MS
- Jena_623-70-1_light[3]
- Jena_623-70-1_light[2]
- CROTONIC ACID ETHYL ESTER; EI-B; MS
- Jena_623-70-1_light[5]
- Jena_623-70-1_light[1]
- Propyl ethoxy ethyl Des Br[2]
-
ethyl 2-methylbenzoate Molecule
InChIKey SOUAXOGPALPTTC-UHFFFAOYSA-N Molecular Formula C10H12O2
Related Dataset(s)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- ETHYL O-TOLUATE; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- ETHYL ORTHO TOLUATE; EI-B; MS
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
-
ethyl 4-acetamidobenzoate Molecule
InChIKey NHLOBHNRBWKNIO-UHFFFAOYSA-N Molecular Formula C11H13NO3
Related Dataset(s)
-
ethyl 4-oxopentanoate Molecule
InChIKey GMEONFUTDYJSNV-UHFFFAOYSA-N Molecular Formula C7H12O3
Related Dataset(s)
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- ETHYL 4-OXOPENTANOATE; EI-B; MS
- ETHYL LEVULINATE; EI-B; MS
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- ETHYL LEVULINATE; EI-B; MS
- 1H--1H correlation spectroscopy (1H-1H COSY)
-
ethyl acetate Molecule
InChIKey XEKOWRVHYACXOJ-UHFFFAOYSA-N
Related Dataset(s)
-
ethylbenzene Molecule
InChIKey YNQLUTRBYVCPMQ-UHFFFAOYSA-N Molecular Formula C8H10
Related Dataset(s)
-
furan-2-carbaldehyde Molecule
InChIKey HYBBIBNJHNGZAN-UHFFFAOYSA-N Molecular Formula C5H4O2
Related Dataset(s)
- distortionless enhancement with polarization transfer (DEPT)
- FURFURAL; EI-B; MS
- FURFURAL; EI-B; MS
- 13C nuclear magnetic resonance spectroscopy (13C NMR)
- FURFURAL; EI-B; MS
- 1H nuclear magnetic resonance spectroscopy (1H NMR)
- 1H--13C heteronuclear single quantum coherence (1H-13C HSQC)
- 1H--13C heteronuclear multiple bond coherence (13C-1H HMBC)
- distortionless enhancement with polarization transfer (DEPT)
- 1H--1H correlation spectroscopy (1H-1H COSY)
- FURFURAL; CI-B; MS
