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

*Links on SpectraBase are not permalinks.
2-(4-Chlorobenzoyl)-4,4,5-trimethyl-2-pyrazolin-3-one
SpectraBase Compound ID 7RdmDKjuV06
InChI InChI=1S/C13H13ClN2O2/c1-8-13(2,3)12(18)16(15-8)11(17)9-4-6-10(14)7-5-9/h4-7H,1-3H3
InChIKey IFCLSMJHXXGHSY-UHFFFAOYSA-N
Mol Weight 264.71 g/mol
Molecular Formula C13H13ClN2O2
Exact Mass 264.066555 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 3vBtK8B8wI0
Name 2-(4-Chlorobenzoyl)-4,4,5-trimethyl-2-pyrazolin-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13ClN2O2
InChI InChI=1S/C13H13ClN2O2/c1-8-13(2,3)12(18)16(15-8)11(17)9-4-6-10(14)7-5-9/h4-7H,1-3H3
InChIKey IFCLSMJHXXGHSY-UHFFFAOYSA-N
Molecular Weight 264.712 g/mol
SMILES C1(=NN(C(C1(C)C)=O)C(c1ccc(cc1)Cl)=O)C
SPLASH splash10-01p9-0960000000-32ff91033b17eba0cbcd
Source of Spectrum Y-28-49-2
Synonyms 2-(4-Chlorobenzoyl)-4,4,5-trimethyl-pyrazol-3-one 2-(4-Chlorophenyl)carbonyl-4,4,5-trimethyl-pyrazol-3-one 2-[(4-chlorophenyl)-oxomethyl]-4,4,5-trimethyl-3-pyrazolone
Wiley ID 1267649