For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
2,5-Cyclohexadien-1-one, 4-chloro-4-(1-methylethyl)-
SpectraBase Compound ID JFKRYj62pAY
InChI InChI=1S/C9H11ClO/c1-7(2)9(10)5-3-8(11)4-6-9/h3-7H,1-2H3
InChIKey NWCMOHCWZDQGAF-UHFFFAOYSA-N
Mol Weight 170.64 g/mol
Molecular Formula C9H11ClO
Exact Mass 170.049843 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID K3COV8iPCnk
Name 2,5-Cyclohexadien-1-one, 4-chloro-4-(1-methylethyl)-
CAS Registry Number 70264-61-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H11ClO
InChI InChI=1S/C9H11ClO/c1-7(2)9(10)5-3-8(11)4-6-9/h3-7H,1-2H3
InChIKey NWCMOHCWZDQGAF-UHFFFAOYSA-N
Molecular Weight 170.639 g/mol
SMILES C1(C=CC(C=C1)=O)(Cl)C(C)C
SPLASH splash10-00b9-1900000000-b3ae786eb2b5961912de
Source of Spectrum I-57-556-0
Synonyms 4-Chloro-4-isopropyl-2,5-cyclohexadien-1-one 4-Chloro-4-isopropylcyclohexa-2,5-dienone
Wiley ID 1166466