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1-Cyclohexene-1-carboxaldehyde, 5,5-dimethyl-3-oxo-
SpectraBase Compound ID F7TSyieupS2
InChI InChI=1S/C9H12O2/c1-9(2)4-7(6-10)3-8(11)5-9/h3,6H,4-5H2,1-2H3
InChIKey PIGJMFZYQUTSNI-UHFFFAOYSA-N
Mol Weight 152.19 g/mol
Molecular Formula C9H12O2
Exact Mass 152.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Kk4WhSZvcPA
Name 1-Cyclohexene-1-carboxaldehyde, 5,5-dimethyl-3-oxo-
Alternate Name(s) 5,5-Dimethyl-3-oxo-1-cyclohexene-1-carbaldehyde 3-Keto-5,5-dimethyl-cyclohexene-1-carbaldehyde 5,5-Dimethyl-3-oxidanylidene-cyclohexene-1-carbaldehyde 5,5-Dimethyl-3-oxo-1-cyclohexenecarboxaldehyde Ketoisophorone 5,5-Dimethyl-3-oxo-cyclohexene-1-carbaldehyde 5,5-Dimethyl-3-oxocyclohex-1-enecarbaldehyde 5,5-Dimethyl-3-oxocyclohexene-1-carbaldehyde
CAS Registry Number 56621-35-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O2
InChI InChI=1S/C9H12O2/c1-9(2)4-7(6-10)3-8(11)5-9/h3,6H,4-5H2,1-2H3
InChIKey PIGJMFZYQUTSNI-UHFFFAOYSA-N
Molecular Weight 152.193 g/mol
SMILES C1(=O)C=C(CC(C1)(C)C)C=O
SPLASH splash10-0gba-9200000000-1a562f117794921f49b7
Wiley ID 1487609