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(6R,1'S)-3-Methyl-6-(1',5'-dimethyl-1'-hydroxy-4-hexen-1'-yl)-cyclohex-2-en-1-one
SpectraBase Compound ID GowJNqjXPYD
InChI InChI=1S/C15H24O2/c1-11(2)6-5-9-15(4,17)13-8-7-12(3)10-14(13)16/h6,10,13,17H,5,7-9H2,1-4H3/t13-,15-/m0/s1
InChIKey HYQNKKAJVPMBDR-ZFWWWQNUSA-N
Mol Weight 236.35 g/mol
Molecular Formula C15H24O2
Exact Mass 236.17763 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J1gIeLVRSEm
Name (6R,1'S)-3-Methyl-6-(1',5'-dimethyl-1'-hydroxy-4-hexen-1'-yl)-cyclohex-2-en-1-one
CAS Registry Number 106145-00-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H24O2
InChI InChI=1S/C15H24O2/c1-11(2)6-5-9-15(4,17)13-8-7-12(3)10-14(13)16/h6,10,13,17H,5,7-9H2,1-4H3/t13-,15-/m0/s1
InChIKey HYQNKKAJVPMBDR-ZFWWWQNUSA-N
Molecular Weight 236.355 g/mol
SMILES O[C@]([C@@]1(C(C=C(CC1)C)=O)[H])(CCC=C(C)C)C
SPLASH splash10-03e9-9710000000-7ae144ad4f6927e30134
Source of Spectrum F-42-5899-2
Synonyms (6s,1'r)-(+)-isomer [(+)-epihernandulcin] (6R)-6-[(1S)-1-hydroxy-1,5-dimethyl-4-hexenyl]-3-methyl-2-cyclohexen-1-one (6S,1'R)-(+)-Isomer[(+)-Epihernandulcin] epi-3-Methyl-6-(1',5'-dimethyl-1'-hydroxy-4-hexen-1'-yl)-cyclohex-2-en-1-one Epi-hernandulcin
Wiley ID 1238687