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6-Epi-shyobunol

View entire compound with spectra: 2 MS (GC)

6-Epi-shyobunol
SpectraBase Compound ID DMgsdgFAiGo
InChI InChI=1S/C15H26O/c1-7-15(6)9-8-12(10(2)3)14(16)13(15)11(4)5/h7,10,12-14,16H,1,4,8-9H2,2-3,5-6H3/t12-,13+,14-,15+/m0/s1
InChIKey WOULTTPZJDSDEI-LJISPDSOSA-N
Mol Weight 222.37 g/mol
Molecular Formula C15H26O
Exact Mass 222.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KX3xi6zBArX
Name 6-Epi-shyobunol
Classification Elemane sesquiterpenoids
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 222.198365456 u
Formula C15H26O
InChI InChI=1S/C15H26O/c1-7-15(6)9-8-12(10(2)3)14(16)13(15)11(4)5/h7,10,12-14,16H,1,4,8-9H2,2-3,5-6H3/t12-,13+,14-,15+/m0/s1
InChIKey WOULTTPZJDSDEI-LJISPDSOSA-N
Molecular Weight 222.372 g/mol
Number of Peaks 29
SMILES O[C@@]1([C@@](C(=C)C)([C@@](CC[C@]1(C(C)C)[H])(C=C)C)[H])[H]
SPLASH splash10-067i-9300000000-1e549c2b12ef9f8dcc83
Source of Spectrum FF-15-400-32 (DOI: 10.1002_1099-1026(200011_12)15_6_395)
Synonyms (1S,2S,3S,6S)-6-isopropyl-3-methyl-2-(prop-1-en-2-yl)-3-vinylcyclohexanol
Wiley ID 1775281