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Alismol
SpectraBase Compound ID 8mYxuPFFm4I
InChI InChI=1S/C15H24O/c1-10(2)12-6-5-11(3)13-7-8-15(4,16)14(13)9-12/h9-10,13-14,16H,3,5-8H2,1-2,4H3/t13-,14-,15-/m0/s1
InChIKey BUPJOLXWQXEJSQ-KKUMJFAQSA-N
Mol Weight 220.36 g/mol
Molecular Formula C15H24O
Exact Mass 220.182715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5fa7GV8SzBg
Name Alismol
Classification Guaianes
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 220.182715392 u
Formula C15H24O
InChI InChI=1S/C15H24O/c1-10(2)12-6-5-11(3)13-7-8-15(4,16)14(13)9-12/h9-10,13-14,16H,3,5-8H2,1-2,4H3/t13-,14-,15-/m0/s1
InChIKey BUPJOLXWQXEJSQ-KKUMJFAQSA-N
Molecular Weight 220.356 g/mol
Number of Peaks 40
SMILES O[C@]1(CC[C@@]2([C@@]1(C=C(CCC2=C)C(C)C)[H])[H])C
SPLASH splash10-052f-7900000000-50a343d47ba9656c141a
Source of Spectrum FF-26-57-6 (DOI: 10.1002/ffj.2016)
Synonyms (1S,3aR,8aS)-7-isopropyl-1-methyl-4-methylene-1,2,3,3a,4,5,6,8a-octahydroazulen-1-ol (1S,3aR,8aS)-1-methyl-4-methylene-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulen-1-ol (1S,3aR,8aS)-1-methyl-4-methylidene-7-propan-2-yl-2,3,3a,5,6,8a-hexahydroazulen-1-ol
Wiley ID 1775534