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(5S,6S)-9-Demethyl-7,8-dihydroretinal
SpectraBase Compound ID D5ZXPABcoGQ
InChI InChI=1S/C19H28O/c1-16(13-15-20)10-7-5-6-8-12-18-17(2)11-9-14-19(18,3)4/h5-8,10,12-13,15,17-18H,9,11,14H2,1-4H3/b6-5+,10-7+,12-8+,16-13+/t17-,18+/m0/s1
InChIKey NALAUYANPQRFOK-MIVIGFEJSA-N
Mol Weight 272.43 g/mol
Molecular Formula C19H28O
Exact Mass 272.214016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YAL2KdZ3aJ
Name (5S,6S)-9-Demethyl-7,8-dihydroretinal
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O
InChI InChI=1S/C19H28O/c1-16(13-15-20)10-7-5-6-8-12-18-17(2)11-9-14-19(18,3)4/h5-8,10,12-13,15,17-18H,9,11,14H2,1-4H3/b6-5+,10-7+,12-8+,16-13+/t17-,18+/m0/s1
InChIKey NALAUYANPQRFOK-MIVIGFEJSA-N
Molecular Weight 272.432 g/mol
SMILES [C@]1(C(CCC[C@@]1(C)[H])(C)C)(\C=C\C=C\C=C\C(=C\C=O)C)[H]
SPLASH splash10-05am-3930000000-43334a7bb214f0ad9dbc
Source of Spectrum F-51-2449-47
Synonyms (2E,4E,6E,8E)-3-methyl-9-(2,6,6-trimethyl-1-cyclohexen-1-yl)-2,4,6,8-nonatetraen-1-ol 9-Demethylretinol
Wiley ID 791247