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1H-Indene-1,5(4H)-dione, 2,3,3a,7a-tetrahydro-3,3a,7a-trimethyl-, [3S-(3.alpha.,3a.beta.,7a.beta.)]-
SpectraBase Compound ID 3JsgL4A9oo7
InChI InChI=1S/C12H16O2/c1-8-6-10(14)11(2)5-4-9(13)7-12(8,11)3/h4-5,8H,6-7H2,1-3H3/t8-,11+,12-/m0/s1
InChIKey IYJGEWUQAFEEEL-AXTRIDKLSA-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 2yRXN5PO8fB
Name 1H-Indene-1,5(4H)-dione, 2,3,3a,7a-tetrahydro-3,3a,7a-trimethyl-, [3S-(3.alpha.,3a.beta.,7a.beta.)]-
CAS Registry Number 79897-29-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O2
InChI InChI=1S/C12H16O2/c1-8-6-10(14)11(2)5-4-9(13)7-12(8,11)3/h4-5,8H,6-7H2,1-3H3/t8-,11+,12-/m0/s1
InChIKey IYJGEWUQAFEEEL-AXTRIDKLSA-N
Molecular Weight 192.258 g/mol
SMILES [C@]12([C@]([C@@](C)(CC2=O)[H])(CC(C=C1)=O)C)C
SPLASH splash10-05i3-6900000000-5fcf4eb4d426eb084ab6
Source of Spectrum KC-1981-1999-0
Synonyms (+)-(3S,3aS,7aS)-2,3,3a,7a-tetrahydro-3,3a,7a-trimethylindene-1,5(4H)-dione (3S,3aS,7aS)-3,3a,7a-trimethyl-2,3,3a,7a-tetrahydro-1H-indene-1,5(4H)-dione
Wiley ID 1188660