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(2S,3S,6S)-2-[(1R)-1-Hydroxy-2-methylallyl]-6-methyl-3-(prop-1-en-2-yl)cyclohexanone
SpectraBase Compound ID 42Q9MGexG1o
InChI InChI=1S/C14H22O2/c1-8(2)11-7-6-10(5)14(16)12(11)13(15)9(3)4/h10-13,15H,1,3,6-7H2,2,4-5H3/t10-,11+,12-,13-/m0/s1
InChIKey QQTAFYGHZDHJQD-RNJOBUHISA-N
Mol Weight 222.33 g/mol
Molecular Formula C14H22O2
Exact Mass 222.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ybCO6QKsYU
Name (2S,3S,6S)-2-[(1R)-1-Hydroxy-2-methylallyl]-6-methyl-3-(prop-1-en-2-yl)cyclohexanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O2
InChI InChI=1S/C14H22O2/c1-8(2)11-7-6-10(5)14(16)12(11)13(15)9(3)4/h10-13,15H,1,3,6-7H2,2,4-5H3/t10-,11+,12-,13-/m0/s1
InChIKey QQTAFYGHZDHJQD-RNJOBUHISA-N
Molecular Weight 222.328 g/mol
SMILES O[C@]([C@]1(C(=O)[C@@](C)(CC[C@@]1(C(=C)C)[H])[H])[H])(C(=C)C)[H]
SPLASH splash10-0159-9300000000-a7af35a8f9f42a67d451
Source of Spectrum F4-41-3947-19
Wiley ID 1673210