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4-CHLORO-4-METHYLCYCLOHEXA-2,5-DIENONE
SpectraBase Compound ID F2RyjWn0QAJ
InChI InChI=1S/C7H7ClO/c1-7(8)4-2-6(9)3-5-7/h2-5H,1H3
InChIKey OEDRUDVULHOSDM-UHFFFAOYSA-N
Mol Weight 142.58 g/mol
Molecular Formula C7H7ClO
Exact Mass 142.018543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9tbp3cfaCYr
Name 2,5-Cyclohexadien-1-one, 4-chloro-4-methyl-
CAS Registry Number 56180-49-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H7ClO
InChI InChI=1S/C7H7ClO/c1-7(8)4-2-6(9)3-5-7/h2-5H,1H3
InChIKey OEDRUDVULHOSDM-UHFFFAOYSA-N
Molecular Weight 142.585 g/mol
SMILES C1(C=CC(C=C1)=O)(Cl)C
SPLASH splash10-0a4i-2900000000-6d272a4978c56a33b70d
Source of Spectrum I-57-555-0
Synonyms 4-Chloranyl-4-methyl-cyclohexa-2,5-dien-1-one 4-Chloro-4-methyl-1-cyclohexa-2,5-dienone 4-Chloro-4-methyl-2,5-cyclohexadien-1-one 4-Chloro-4-methyl-cyclohexa-2,5-dien-1-one
Wiley ID 1140740