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

*Links on SpectraBase are not permalinks.
(5-Oxo-1-phenyl-4-thiophen-2-ylmethylene-4,5-dihydro-1H-pyrazol-3-yl)acetic acid, methyl ester
SpectraBase Compound ID 9Zjurxe24sB
InChI InChI=1S/C17H14N2O3S/c1-22-16(20)11-15-14(10-13-8-5-9-23-13)17(21)19(18-15)12-6-3-2-4-7-12/h2-10H,11H2,1H3/b14-10-
InChIKey GYZPBSNCXCULGN-UVTDQMKNSA-N
Mol Weight 326.37 g/mol
Molecular Formula C17H14N2O3S
Exact Mass 326.072513 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 BqB5xS0kr0c
Name (5-Oxo-1-phenyl-4-thiophen-2-ylmethylene-4,5-dihydro-1H-pyrazol-3-yl)acetic acid, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O3S
InChI InChI=1S/C17H14N2O3S/c1-22-16(20)11-15-14(10-13-8-5-9-23-13)17(21)19(18-15)12-6-3-2-4-7-12/h2-10H,11H2,1H3/b14-10-
InChIKey GYZPBSNCXCULGN-UVTDQMKNSA-N
Molecular Weight 326.370 g/mol
SMILES C1(=NN(C(\C1=C\c1cccs1)=O)c1ccccc1)CC(OC)=O
SPLASH splash10-004i-9523000000-76c261424b6e33e7f513
Synonyms 2-[(4Z)-5-keto-1-phenyl-4-(2-thenylidene)-2-pyrazolin-3-yl]acetic acid methyl ester 2-[(4Z)-5-oxo-1-phenyl-4-(thiophen-2-ylmethylidene)-3-pyrazolyl]acetic acid methyl ester Methyl 2-[(4Z)-5-oxidanylidene-1-phenyl-4-(thiophen-2-ylmethylidene)pyrazol-3-yl]ethanoate Methyl 2-[(4Z)-5-oxo-1-phenyl-4-(2-thienylmethylene)pyrazol-3-yl]acetate Methyl 2-[(4Z)-5-oxo-1-phenyl-4-(thiophen-2-ylmethylidene)pyrazol-3-yl]acetate
Wiley ID 1437267