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(1R,3aR,8R,8aS)-1-methyl-8-(1-methylethenyl)-2,3,3a,7,8,8a-hexahydro-1H-azulen-4-one
SpectraBase Compound ID Cs6f4F3cYEN
InChI InChI=1S/C14H20O/c1-9(2)11-5-4-6-13(15)12-8-7-10(3)14(11)12/h4,6,10-12,14H,1,5,7-8H2,2-3H3/t10-,11+,12+,14+/m1/s1
InChIKey SLFKVRAEXJKJJS-UHXUPSOCSA-N
Mol Weight 204.31 g/mol
Molecular Formula C14H20O
Exact Mass 204.151415 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LfGaUqdiqZv
Name (1R,3aR,8R,8aS)-1-methyl-8-(1-methylethenyl)-2,3,3a,7,8,8a-hexahydro-1H-azulen-4-one
Alternate Name(s) (1R,3aR,8R,8aS)-1-methyl-8-prop-1-en-2-yl-2,3,3a,7,8,8a-hexahydro-1H-azulen-4-one (1R,3aR,8R,8aS)-8-isopropenyl-1-methyl-2,3,3a,7,8,8a-hexahydro-1H-azulen-4-one
CAS Registry Number 132842-94-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O
InChI InChI=1S/C14H20O/c1-9(2)11-5-4-6-13(15)12-8-7-10(3)14(11)12/h4,6,10-12,14H,1,5,7-8H2,2-3H3/t10-,11+,12+,14+/m1/s1
InChIKey SLFKVRAEXJKJJS-UHXUPSOCSA-N
Molecular Weight 204.313 g/mol
SMILES [C@@]12([C@](C(C=CC[C@]2(C(=C)C)[H])=O)(CC[C@]1(C)[H])[H])[H]
SPLASH splash10-0acc-1900000000-746972cfc498f55d4386
Source of Spectrum F-46-7244-11
Wiley ID 1202343