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2,3,3a,6,7,7a-Hexahydro-3a,4-dimethylindene-1,5(4H)-dione
SpectraBase Compound ID 2dOYNOuE7qB
InChI InChI=1S/C11H16O2/c1-7-9(12)4-3-8-10(13)5-6-11(7,8)2/h7-8H,3-6H2,1-2H3/t7-,8+,11+/m1/s1
InChIKey JXPXCGQTKHZUOC-FYBVGQRMSA-N
Mol Weight 180.25 g/mol
Molecular Formula C11H16O2
Exact Mass 180.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6pbearld7Ju
Name 2,3,3a,6,7,7a-Hexahydro-3a,4-dimethylindene-1,5(4H)-dione
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H16O2
InChI InChI=1S/C11H16O2/c1-7-9(12)4-3-8-10(13)5-6-11(7,8)2/h7-8H,3-6H2,1-2H3/t7-,8+,11+/m1/s1
InChIKey JXPXCGQTKHZUOC-FYBVGQRMSA-N
Molecular Weight 180.247 g/mol
SMILES [C@]12([C@](C(=O)CC2)(CCC([C@]1(C)[H])=O)[H])C
SPLASH splash10-02al-8900000000-183d66ff6aafcfc2eb0f
Source of Spectrum K1-2001-2421-27
Synonyms (3aS,4S,7aR)-3a,4-Dimethyl-hexahydro-indene-1,5-dione 3a,4-dimethylhexahydro-1H-indene-1,5(4H)-dione (3aS,4S,7aR)-3a,4-dimethyl-2,3,4,6,7,7a-hexahydroindene-1,5-dione
Wiley ID 813922