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1,5-Cyclohexadiene-1-carboxaldehyde, 4,4-dimethyl-
SpectraBase Compound ID K9ibhiUs6uU
InChI InChI=1S/C9H12O/c1-9(2)5-3-8(7-10)4-6-9/h3-5,7H,6H2,1-2H3
InChIKey PBWHPANHVKPNLN-UHFFFAOYSA-N
Mol Weight 136.19 g/mol
Molecular Formula C9H12O
Exact Mass 136.088815 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EzgqtwFZhbn
Name 1,5-Cyclohexadiene-1-carboxaldehyde, 4,4-dimethyl-
CAS Registry Number 97997-08-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12O
InChI InChI=1S/C9H12O/c1-9(2)5-3-8(7-10)4-6-9/h3-5,7H,6H2,1-2H3
InChIKey PBWHPANHVKPNLN-UHFFFAOYSA-N
Molecular Weight 136.194 g/mol
SMILES C=1(C=CC(CC1)(C)C)C=O
SPLASH splash10-0006-9200000000-3f0303b27cbd2580d403
Source of Spectrum J-50-4043-3
Synonyms 4,4-Dimethyl-1,5-cyclohexadiene-1-carbaldehyde 4,4-Dimethyl-1,5-cyclohexadienecarbaldehyde 4,4-Dimethyl-1-cyclohexa-1,5-dienecarboxaldehyde
Wiley ID 1136342