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1,7-Naphthalenedione, octahydro-2,4a-dimethyl-, (2.alpha.,4a.alpha.,8a.beta.)-(.+-.)-
SpectraBase Compound ID 8SkAFaSIA5d
InChI InChI=1S/C12H18O2/c1-8-3-5-12(2)6-4-9(13)7-10(12)11(8)14/h8,10H,3-7H2,1-2H3
InChIKey ZQBUPHBFCZDUAH-UHFFFAOYSA-N
Mol Weight 194.27 g/mol
Molecular Formula C12H18O2
Exact Mass 194.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 21v0Ii0sCZ7
Name 1,7-Naphthalenedione, octahydro-2,4a-dimethyl-, (2.alpha.,4a.alpha.,8a.beta.)-(.+-.)-
Alternate Name(s) 2,4a-dimethyl-3,4,5,6,8,8a-hexahydro-2H-naphthalene-1,7-dione (+-)-Octahydro-2,4a-dimethyl-1,7-naphthalenedione 2,4a-dimethyldecalin-1,7-dione 2,4a-dimethyldecalin-1,7-quinone 2,4a-dimethyloctahydro-1,7-naphthalenedione
CAS Registry Number 96617-02-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O2
InChI InChI=1S/C12H18O2/c1-8-3-5-12(2)6-4-9(13)7-10(12)11(8)14/h8,10H,3-7H2,1-2H3
InChIKey ZQBUPHBFCZDUAH-UHFFFAOYSA-N
Molecular Weight 194.274 g/mol
SMILES C12C(=O)C(C)CCC2(CCC(C1)=O)C
SPLASH splash10-03dl-0900000000-eaf0e49c8c5b4d11b86c
Source of Spectrum J-50-2652-0
Wiley ID 1191140