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(3aS,7aR)-7a-allylhexahydro-1H-indene-1,7(7aH)-dione
SpectraBase Compound ID LZrUHz7vpG9
InChI InChI=1S/C12H16O2/c1-2-8-12-9(6-7-11(12)14)4-3-5-10(12)13/h2,9H,1,3-8H2/t9-,12+/m0/s1
InChIKey PJTBLQFEVVNYJU-JOYOIKCWSA-N
Mol Weight 192.26 g/mol
Molecular Formula C12H16O2
Exact Mass 192.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RRaTbDGWu
Name (3aS,7aR)-7a-allylhexahydro-1H-indene-1,7(7aH)-dione
Alternate Name(s) 1-Allylbicyclo[4.3.0]nonane-2,9-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-2-8-12-9(6-7-11(12)14)4-3-5-10(12)13/h2,9H,1,3-8H2/t9-,12+/m0/s1
InChIKey PJTBLQFEVVNYJU-JOYOIKCWSA-N
Literature Reference DOI 10.1002/adsc.200700046
Molecular Weight 192.258 g/mol
SMILES C1CC[C@]2(CCC([C@]2(C1=O)CC=C)=O)[H]
SPLASH splash10-004u-5900000000-7993344cdc9e41c37caf
Source of Spectrum ASC-349-1358-10
Wiley ID 1765653