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1H-Indene-1,5(4H)-dione, 3a,7a-dihydro-3a,7a-dimethyl-, (3aS-cis)-
SpectraBase Compound ID 2cwtkOdJiR4
InChI InChI=1S/C11H12O2/c1-10-5-4-9(13)11(10,2)6-3-8(12)7-10/h3-6H,7H2,1-2H3/t10-,11+/m0/s1
InChIKey INTWPHSRSANLLU-WDEREUQCSA-N
Mol Weight 176.21 g/mol
Molecular Formula C11H12O2
Exact Mass 176.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HAV8JjLxy9N
Name 1H-Indene-1,5(4H)-dione, 3a,7a-dihydro-3a,7a-dimethyl-, (3aS-cis)-
Alternate Name(s) (+)-(3aR,7aS)-3a,7a-Dihydro-3a,7a-dimethylindene-1,5(4H)-dione (3aR,7aS)-3a,7a-dimethyl-3a,7a-dihydro-1H-indene-1,5(4H)-dione
CAS Registry Number 79898-06-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12O2
InChI InChI=1S/C11H12O2/c1-10-5-4-9(13)11(10,2)6-3-8(12)7-10/h3-6H,7H2,1-2H3/t10-,11+/m0/s1
InChIKey INTWPHSRSANLLU-WDEREUQCSA-N
Molecular Weight 176.215 g/mol
SMILES [C@]12([C@@](C=CC2=O)(CC(C=C1)=O)C)C
SPLASH splash10-0a7l-4900000000-a84e75fcfb54461d244d
Source of Spectrum KC-1981-1999-0
Wiley ID 1172415