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23,309 molecules found

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• (1R)-1-(2,2,3,3,4,4,4-heptafluorobutyl)-7-methyl-1,2,3,4-tetrahydronaphthalene Molecule

  InChIKey	HRUGRXKWCCWWEE-LLVKDONJSA-N
  Molecular Formula	C15H15F7

  

  
  

  Related Dataset(s)

  • 7-Methyl-1-(2,2,3,3,4,4,4-heptafluorobutyl)-1,2,3,4-tetrahydronaphthalene; GC-EI-TOF; MS; POSITIVE; 70 V

• (1R)-1-(5-tricyclo[8.2.2.24,7]hexadeca-1(13),4,6,10(14),11,15-hexaenyl)ethanol Molecule

  InChIKey	IOOIGEUVTBOKRL-CYBMUJFWSA-N
  Molecular Formula	C18H20O

  

  
  

  Related Dataset(s)

  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • fast-atom bombardment mass spectrometry (FABMS)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • infrared absorption spectroscopy (IR)
  • infrared absorption spectroscopy (IR)
  • infrared absorption spectroscopy (IR)

• (1R)-1-(furan-2-yl)nonan-1-ol Molecule

  InChIKey	WCDUEUSLTDIZHW-GFCCVEGCSA-N
  Molecular Formula	C13H22O2

  

  
  

  Related Dataset(s)

  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • 8a_Varian[8a_HEE286_20140131_21.1H.fid]
  • high-resolution mass spectrometry (HRMS)
  • 8a_Varian[8a_HEE286_20140131_21.13C.fid]
  • 8a_Varian[8a_HEE286_20140131_21.dept.fid]

• (1R)-1-(furan-2-yl)tridecan-1-ol Molecule

  InChIKey	KWSOXPPLWZODNZ-MRXNPFEDSA-N
  Molecular Formula	C17H30O2

  

  
  

  Related Dataset(s)

  • 8c_Varian.
  • high-resolution mass spectrometry (HRMS)
  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • 8c_Varian.
  • 8c_Varian[8c_HEE240_20131129_02.1H.fid]

• (1R)-1-(furan-2-yl)undecan-1-ol Molecule

  InChIKey	XDKMPPWBMLMXLH-CQSZACIVSA-N
  Molecular Formula	C15H26O2

  

  
  

  Related Dataset(s)

  • 13C nuclear magnetic resonance spectroscopy (13C NMR)
  • 8b_Varian[8b_HEE305_20140219_04.13C.fid]
  • 1H nuclear magnetic resonance spectroscopy (1H NMR)
  • 8b_Varian[8b_HEE305_20140219_04.1H.fid]
  • high-resolution mass spectrometry (HRMS)
  • 8b_Varian[8b_HEE305_20140219_04.dept.fid]

• (1R)-1-[(2R,3aR,5R,6S,6aR)-6-hydroxy-2-(trichloromethyl)-3a,5,6,6a-tetrahydro... Molecule

  InChIKey	OJYGBLRPYBAHRT-IPQSZEQASA-N
  Molecular Formula	C8H11Cl3O6

  

  
  

  Related Dataset(s)

  • Chloralose; LC-ESI-QFT; MS2; CE: 15; R=17500; [M-H]-
  • Chloralose; LC-ESI-QFT; MS2; CE: 45; R=17500; [M-H]-
  • Chloralose; LC-ESI-QFT; MS2; CE: 90; R=17500; [M-H]-
  • Chloralose; LC-ESI-QFT; MS2; CE: 30; R=17500; [M-H]-
  • Chloralose; LC-ESI-QFT; MS2; CE: 60; R=17500; [M-H]-
  • Chloralose; LC-ESI-QFT; MS2; CE: 75; R=17500; [M-H]-

• (1R)-1-[4-[(2S,6R)-4-(4,6-dimethyl-1,3,5-triazin-2-yl)-2,6-dimethylpiperazin-... Molecule

  InChIKey	FTEQMUXMWCGJAF-GRYCIOLGSA-N
  Molecular Formula	C17H25N7O

  

  
  

  Related Dataset(s)

  • CP-642931; LC-ESI-QFT; MS2; CE: 15; R=17500; [M+H]+
  • CP-642931; LC-ESI-QFT; MS2; CE: 30; R=17500; [M+H]+
  • CP-642931; LC-ESI-QFT; MS2; CE: 75; R=17500; [M+H]+
  • CP-642931; LC-ESI-QFT; MS2; CE: 90; R=17500; [M+H]+
  • CP-642931; LC-ESI-QFT; MS2; CE: 60; R=17500; [M+H]+
  • CP-642931; LC-ESI-QFT; MS2; CE: 45; R=17500; [M+H]+

• (1R)-1-[[(2S,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo... Molecule

  InChIKey	DTGZHCFJNDAHEN-OZEXIGSWSA-N
  Molecular Formula	C28H38N2O4

  

  
  

  Related Dataset(s)

  • Cephaeline; LC-ESI-QTOF; MS2
  • Cephaeline; LC-ESI-QTOF; MS2
  • Cephaeline; LC-ESI-QTOF; MS2
  • Cephaeline; LC-ESI-QTOF; MS2
  • Cephaeline; LC-ESI-QTOF; MS2
  • Cephaeline; LC-ESI-QTOF; MS2
  • Cephaeline; LC-ESI-QTOF; MS2
  • Cephaeline; LC-ESI-QTOF; MS2
  • Cephaeline; LC-ESI-QTOF; MS2

• (1R)-1-phenylethanamine Molecule

  InChIKey	RQEUFEKYXDPUSK-SSDOTTSWSA-N
  Molecular Formula	C8H11N

  

  
  

  Related Dataset(s)

  • (+)-ALPHA-PHENYLETHYLAMINE; EI-B; MS
  • L-(-)-ALPHA-PHENYLETHYLAMINE; EI-B; MS

• (1R)-20,21,25-trimethoxy-15,30-dimethyl-8,23-dioxa-15,30-diazaheptacyclo[22.6... Molecule

  InChIKey	HGNHIFJNOKGSKI-FICMROCWSA-N
  Molecular Formula	C37H40N2O6

  

  
  

  Related Dataset(s)

  • Oxyacanthine; LC-ESI-QTOF; MS2
  • Oxyacanthine; LC-ESI-QTOF; MS2
  • Oxyacanthine; LC-ESI-QTOF; MS2
  • Oxyacanthine; LC-ESI-QTOF; MS2
  • Oxyacanthine; LC-ESI-QTOF; MS2
  • Oxyacanthine; LC-ESI-QTOF; MS2
  • Oxyacanthine; LC-ESI-QTOF; MS2
  • Oxyacanthine; LC-ESI-QTOF; MS2
  • Oxyacanthine; LC-ESI-QTOF; MS2
  • Oxyacanthine; LC-ESI-QTOF; MS2

• (1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E)-3,7,12,16-tetramethyl-18-(2,... Molecule

  InChIKey	GMIFARVLXYYPTL-DIXBGOFRSA-N
  Molecular Formula	C40H60O

  

  
  

  Related Dataset(s)

  • 7',8',9',10'-Tetrahydro-beta-cryptoxanthin; FAB-EBEB; MS2; m/z: 556.46; [M]+*

• (1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethy... Molecule

  InChIKey	BMQNSHDVIYZULR-FKKUPVFPSA-N
  Molecular Formula	C40H54O

  

  
  

  Related Dataset(s)

  • Anhydrolutein-III; FAB-EBEB; MS2; m/z: 550.42; [M]+*

• (1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethy... Molecule

  InChIKey	DMASLKHVQRHNES-FKKUPVFPSA-N
  Molecular Formula	C40H56O

  

  
  

  Related Dataset(s)

  • beta-Cryptoxanthin; FAB-EBEB; MS2; m/z: 552.43; [M]+*

• (1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethy... Molecule

  InChIKey	HBHHQQIZEXNSHZ-NHWXEJKLSA-N
  Molecular Formula	C40H54O

  

  
  

  Related Dataset(s)

  • Anhydrolutein-II; FAB-EBEB; MS2; m/z: 550.42; [M]+*

• (1R)-3,5,5-trimethyl-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethy... Molecule

  InChIKey	LLQCIZOXARRMDO-HGTNRAFMSA-N
  Molecular Formula	C40H56O2

  

  
  

  Related Dataset(s)

  • beta-Cryptoxathin-5',6'-epoxide; FAB-EBEB; MS2; m/z: 568.43; [M]+*

• (1R)-3,5,5-trimethyl-4-[(3E,5E,7E,9E,11E,13E,15E,17E)-3,7,12,16-tetramethyl-1... Molecule

  InChIKey	UNJKJDIRJWIHLL-BQLQDKTLSA-N
  Molecular Formula	C40H54O

  

  
  

  Related Dataset(s)

  • Crocoxanthin; FAB-EBEB; MS2; m/z: 550.42; [M]+*
  • Crocoxanthin; FAB-EBEB; MS2; m/z: 550.42; [M]+*

• (1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E)-16-[(7aR)-4,4,7a-trimethyl-2,5,6,7-tetra... Molecule

  InChIKey	WEJIOGMJJWSQFC-UQPOSZEYSA-N
  Molecular Formula	C40H56O2

  

  
  

  Related Dataset(s)

  • beta-Cryptoxathin-5',8'-epoxide; FAB-EBEB; MS2; m/z: 568.43; [M]+*

• (1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E)-18-[(4R)-4-hydroxy-2,6,6-trimethylcycloh... Molecule

  InChIKey	HNYJHQMUSVNWPV-DRCJTWAYSA-N
  Molecular Formula	C40H54O2

  

  
  

  Related Dataset(s)

  • Diatoxanthin; LC-ESI-QTOF; MS2; POSITIVE; ESI; [M+H]+; CE 70 V
  • Diatoxanthin; FAB-EBEB; MS2; m/z: 566.41; [M]+*
  • Diatoxanthin; LC-ESI-QTOF; MS2; POSITIVE; ESI; [M+H]+; CE 20 V

• (1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1R)-6,6-dimethyl-2-methylidenec... Molecule

  InChIKey	UIUSQYGQZRBKCC-NHWXEJKLSA-N
  Molecular Formula	C40H54O

  

  
  

  Related Dataset(s)

  • Anhydrolutein-I; FAB-EBEB; MS2; m/z: 550.42; [M]+*

• (1R)-4-[(1E,3E,5E,7E,9E,11E,13E,15E,17E)-18-[(1R,4R)-4-hydroxy-2,6,6-trimethy... Molecule

  InChIKey	KBPHJBAIARWVSC-RGZFRNHPSA-N
  Molecular Formula	C40H56O2

  

  
  

  Related Dataset(s)

  • Lutein; FAB-EBEB; MS2; m/z: 568.43; [M]+*
  • Lutein; LC-ESI-QTOF; MS2; POSITIVE; ESI; [M+H]+; CE 20 V
  • Lutein; LC-ESI-QTOF; MS2; POSITIVE; ESI; [M+H]+; CE 20 V
  • Lutein; EI-EBEB; MS; POS

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