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2,6-Naphthalenedione, 1,3,4,7,8,8a-hexahydro-5,8a-dimethyl-3-(1-methylethyl)-, cis-(.+-.)-
SpectraBase Compound ID KgLGkgprlWM
InChI InChI=1S/C15H22O2/c1-9(2)11-7-12-10(3)13(16)5-6-15(12,4)8-14(11)17/h9,11H,5-8H2,1-4H3/t11-,15+/m1/s1
InChIKey LNLJAPWFYVVOSW-ABAIWWIYSA-N
Mol Weight 234.34 g/mol
Molecular Formula C15H22O2
Exact Mass 234.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D90hH9dGn73
Name 2,6-Naphthalenedione, 1,3,4,7,8,8a-hexahydro-5,8a-dimethyl-3-(1-methylethyl)-, cis-(.+-.)-
CAS Registry Number 79492-87-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H22O2
InChI InChI=1S/C15H22O2/c1-9(2)11-7-12-10(3)13(16)5-6-15(12,4)8-14(11)17/h9,11H,5-8H2,1-4H3/t11-,15+/m1/s1
InChIKey LNLJAPWFYVVOSW-ABAIWWIYSA-N
Molecular Weight 234.339 g/mol
SMILES C=12[C@](CC([C@](C2)(C(C)C)[H])=O)(CCC(C1C)=O)C
SPLASH splash10-000i-0910000000-a659e54f11c6ba118e4d
Source of Spectrum K-114-2421-0
Synonyms (3R,8aS)-3-isopropyl-5,8a-dimethyl-1,3,4,7,8,8a-hexahydro-2,6-naphthalenedione 1,3,4,7,8,8a-hexahydro-3.beta.-isopropyl-5,8a.beta.-dimethyl-2,6-naphthalenedione
Wiley ID 1236331