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3,3,5-Trimethylcyclohexanone
SpectraBase Compound ID KdVVRSxj9tx
InChI InChI=1S/C9H16O/c1-7-4-8(10)6-9(2,3)5-7/h7H,4-6H2,1-3H3
InChIKey POSWICCRDBKBMH-UHFFFAOYSA-N
Mol Weight 140.23 g/mol
Molecular Formula C9H16O
Exact Mass 140.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ITQRPZqVtDf
Name Cyclohexanone, 3,3,5-trimethyl-
CAS Registry Number 873-94-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O
InChI InChI=1S/C9H16O/c1-7-4-8(10)6-9(2,3)5-7/h7H,4-6H2,1-3H3
InChIKey POSWICCRDBKBMH-UHFFFAOYSA-N
Molecular Weight 140.226 g/mol
SMILES C1(CC(=O)CC(C1)C)(C)C
SPLASH splash10-0kal-9000000000-56e32a07b4e8080ea670
Source of Spectrum F-50-976-9
Synonyms 3,3,5-Trimethyl-1-cyclohexanone 3,3,5-Trimethylcyclohexan-1-one 3,3,5-Trimethylcyclohexanone 3,5,5-Trimethylcyclohexanone Dihydro-isophorone Dihydroisophorone AI3-33978 EINECS 212-855-9
Wiley ID 1139694