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

*Links on SpectraBase are not permalinks.
5-methyl-2-phenyl-4-propan-2-ylidenepyrazol-3-one
SpectraBase Compound ID 52Y1894BUx2
InChI InChI=1S/C13H14N2O/c1-9(2)12-10(3)14-15(13(12)16)11-7-5-4-6-8-11/h4-8H,1-3H3
InChIKey ZSQBZSXNYJOIQD-UHFFFAOYSA-N
Mol Weight 214.27 g/mol
Molecular Formula C13H14N2O
Exact Mass 214.110613 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 4ZTMV2oM9yh
Name 4-isopropylidene-5-methyl-2-phenyl-2-pyrazolin-3-one
Alternate Name(s) 4-isopropylidene-5-methyl-2-phenyl-pyrazol-3-one 5-methyl-2-phenyl-4-propan-2-ylidene-3-pyrazolone 5-methyl-2-phenyl-4-propan-2-ylidene-pyrazol-3-one 5-Methyl-4-(1-methylethylidene)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
CAS Registry Number 22123-17-7
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O
InChI InChI=1S/C13H14N2O/c1-9(2)12-10(3)14-15(13(12)16)11-7-5-4-6-8-11/h4-8H,1-3H3
InChIKey ZSQBZSXNYJOIQD-UHFFFAOYSA-N
Molecular Weight 214.268 g/mol
SMILES C1(N(N=C(C1=C(C)C)C)c1ccccc1)=O
SPLASH splash10-01ot-0890000000-7845e1abeb0fb452241f
Source of Spectrum Y-23-1160-2
Wiley ID 1213797