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2-(.alpha.-hydroxyguaia-1(10),11-dien-15-al isomer
SpectraBase Compound ID DsdWIBiJRjJ
InChI InChI=1S/C15H22O2/c1-9(2)11-4-5-12(8-16)15-13(7-11)10(3)6-14(15)17/h8,10-11,13-14,17H,1,4-7H2,2-3H3/t10-,11+,13-,14-/m0/s1
InChIKey HOIHIYQAKDUVKK-XCCSTKFXSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HDpAnh5vR8l
Name 2-(.alpha.-hydroxyguaia-1(10),11-dien-15-al isomer
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-9(2)11-4-5-12(8-16)15-13(7-11)10(3)6-14(15)17/h8,10-11,13-14,17H,1,4-7H2,2-3H3/t10-,11+,13-,14-/m0/s1
InChIKey HOIHIYQAKDUVKK-XCCSTKFXSA-N
Molecular Weight 234.339 g/mol
SMILES O[C@@]1(C=2[C@@](C[C@](C(=C)C)(CCC2C=O)[H])([C@@](C)(C1)[H])[H])[H]
SPLASH splash10-0ukc-3910000000-049a255eb05efc2d25b8
Source of Spectrum F-48-10274-17
Synonyms (1S,3S,7R,8aS)-3-Hydroxy-7-isopropenyl-1-methyl-1,2,3,5,6,7,8,8a-octahydro-azulene-4-carbaldehyde (3S)-3-hydroxy-7-isopropenyl-4-methyl-1,2,3,5,6,7,8,8a-octahydro-1-azulenecarbaldehyde 2-(.alpha.-ydroxyguaia-1(10),11-dien-15-al isomer
Wiley ID 1236507