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2,5-Cyclohexadien-1-one, 4-chloro-4-(1,1-dimethylethyl)-
SpectraBase Compound ID CnBZ4AnazOi
InChI InChI=1S/C10H13ClO/c1-9(2,3)10(11)6-4-8(12)5-7-10/h4-7H,1-3H3
InChIKey PKJYRQHMJIPDNJ-UHFFFAOYSA-N
Mol Weight 184.67 g/mol
Molecular Formula C10H13ClO
Exact Mass 184.065493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5CdjVIvRclN
Name 2,5-Cyclohexadien-1-one, 4-chloro-4-(1,1-dimethylethyl)-
CAS Registry Number 70264-62-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H13ClO
InChI InChI=1S/C10H13ClO/c1-9(2,3)10(11)6-4-8(12)5-7-10/h4-7H,1-3H3
InChIKey PKJYRQHMJIPDNJ-UHFFFAOYSA-N
Molecular Weight 184.666 g/mol
SMILES C1(C=CC(C=C1)=O)(C(C)(C)C)Cl
SPLASH splash10-0a4i-9800000000-e8ae052fd8d9c1287077
Source of Spectrum I-57-556-0
Synonyms 4-tert-Butyl-4-chloro-2,5-cyclohexadien-1-one 4-tert-Butyl-4-chlorocyclohexa-2,5-dienone
Wiley ID 1180481