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5,5,9-Trimethyl-cis-2-decalone
SpectraBase Compound ID 7kygTQfiwik
InChI InChI=1S/C13H22O/c1-12(2)7-4-8-13(3)9-10(14)5-6-11(12)13/h11H,4-9H2,1-3H3/t11-,13-/m0/s1
InChIKey YZILXDJWJHJLAM-AAEUAGOBSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JhyAu0nkzSr
Name 5,5,9-Trimethyl-cis-2-decalone
Alternate Name(s) (4aS,8aS)-5,5,8a-trimethyloctahydronaphthalen-2(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O
InChI InChI=1S/C13H22O/c1-12(2)7-4-8-13(3)9-10(14)5-6-11(12)13/h11H,4-9H2,1-3H3/t11-,13-/m0/s1
InChIKey YZILXDJWJHJLAM-AAEUAGOBSA-N
Literature Reference DOI 10.1002/hlca.19730560425
Molecular Weight 194.318 g/mol
SMILES CC1(C)[C@@]2(CCC(C[C@@]2(CCC1)C)=O)[H]
SPLASH splash10-03dl-8900000000-8a1b96568b1776a70b2f
Source of Spectrum H-56-1435-2
Wiley ID 1797116