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2,5,5-Trimethyl-2-cyclohexen-1-one
SpectraBase Compound ID 5NIsSqe7Y03
InChI InChI=1S/C9H14O/c1-7-4-5-9(2,3)6-8(7)10/h4H,5-6H2,1-3H3
InChIKey RDQLMOWLZRRRNM-UHFFFAOYSA-N
Mol Weight 138.21 g/mol
Molecular Formula C9H14O
Exact Mass 138.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID J4td8qVk8SN
Name 2,5,5-Trimethyl-2-cyclohexen-1-one
Alternate Name(s) 2,5,5-trimethyl-1-cyclohex-2-enone 2,5,5-trimethylcyclohex-2-en-1-one
CAS Registry Number 42747-41-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O
InChI InChI=1S/C9H14O/c1-7-4-5-9(2,3)6-8(7)10/h4H,5-6H2,1-3H3
InChIKey RDQLMOWLZRRRNM-UHFFFAOYSA-N
Molecular Weight 138.210 g/mol
SMILES C1C(CC=C(C1=O)C)(C)C
SPLASH splash10-001i-9200000000-befc3230a67049cec9e2
Source of Spectrum H-59-90-7
Wiley ID 1138018