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2,6-Naphthalenedione, 1,3,4,7,8,8a-hexahydro-5,8a-dimethyl-3-(1-methylethyl)-, cis-(.+-.)-

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HsCidl5dRlQ
Name 2,6-Naphthalenedione, 1,3,4,7,8,8A-hexahydro-5,8A-dimethyl-3-(1-methylethyl)-, cis-(.+-.)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 234.161979946 u
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