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3,3,5-trimethylcyclohex-5-ene-1,2,4-trione
SpectraBase Compound ID 35KxvY4m8WJ
InChI InChI=1S/C9H10O3/c1-5-4-6(10)8(12)9(2,3)7(5)11/h4H,1-3H3
InChIKey JQNNKORABJOYAI-UHFFFAOYSA-N
Mol Weight 166.18 g/mol
Molecular Formula C9H10O3
Exact Mass 166.062994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H8Hcpyy6kba
Name 5-Cyclohexene-1,2,4-trione, 3,3,5-trimethyl-
CAS Registry Number 108946-73-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H10O3
InChI InChI=1S/C9H10O3/c1-5-4-6(10)8(12)9(2,3)7(5)11/h4H,1-3H3
InChIKey JQNNKORABJOYAI-UHFFFAOYSA-N
Molecular Weight 166.176 g/mol
SMILES C1(C(C(C)=CC(C1=O)=O)=O)(C)C
SPLASH splash10-052b-9300000000-b732519ef0a1d22b0343
Source of Spectrum K-120-1147-5
Synonyms 3,3,5-trimethylcyclohex-5-ene-1,2,4-trione
Wiley ID 1162328