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13,14-Dihydroxyretinol

View entire compound with spectra: 1 MS (GC)

13,14-Dihydroxyretinol
SpectraBase Compound ID KJsvRo49Ylb
InChI InChI=1S/C20H32O3/c1-15(8-6-13-20(5,23)18(22)14-21)10-11-17-16(2)9-7-12-19(17,3)4/h6,8,10-11,13,18,21-23H,7,9,12,14H2,1-5H3/b11-10+,13-6+,15-8+
InChIKey IPJVXOBBCWHWMP-RLGMBWBISA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HmG7DdzBJoO
Name 13,14-Dihydroxyretinol
Alternate Name(s) (4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-4,6,8-triene-1,2,3-triol (4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-4,6,8-triene-1,2,3-triol
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Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-15(8-6-13-20(5,23)18(22)14-21)10-11-17-16(2)9-7-12-19(17,3)4/h6,8,10-11,13,18,21-23H,7,9,12,14H2,1-5H3/b11-10+,13-6+,15-8+
InChIKey IPJVXOBBCWHWMP-RLGMBWBISA-N
Molecular Weight 320.473 g/mol
SMILES OC(CO)C(\C=C\C=C\(\C=C\C1=C(CCCC1(C)C)C)C)(O)C
SPLASH splash10-017i-9250000000-e9002be320c7c446f2d2
Source of Spectrum KD-15-844-3
Wiley ID 1636870