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

*Links on SpectraBase are not permalinks.
2-[1-Chloro-1-(4-nitrophenyl)methyl]-2-cyclohexen-1-one
SpectraBase Compound ID 7rzU1c8g1sr
InChI InChI=1S/C13H12ClNO3/c14-13(11-3-1-2-4-12(11)16)9-5-7-10(8-6-9)15(17)18/h3,5-8,13H,1-2,4H2
InChIKey OVAQXIAVYWIGKZ-UHFFFAOYSA-N
Mol Weight 265.7 g/mol
Molecular Formula C13H12ClNO3
Exact Mass 265.050571 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 2AyHfNfRLKV
Name 2-[1-Chloro-1-(4-nitrophenyl)methyl]-2-cyclohexen-1-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12ClNO3
InChI InChI=1S/C13H12ClNO3/c14-13(11-3-1-2-4-12(11)16)9-5-7-10(8-6-9)15(17)18/h3,5-8,13H,1-2,4H2
InChIKey OVAQXIAVYWIGKZ-UHFFFAOYSA-N
Molecular Weight 265.696 g/mol
SMILES C1(C(=CCCC1)C(c1ccc(cc1)N(=O)=O)Cl)=O
SPLASH splash10-0002-0090000000-09977546e62d494a6992
Source of Spectrum F-54-11823-24
Synonyms 2-[chloro(4-nitrophenyl)methyl]-2-cyclohexen-1-one
Wiley ID 809057