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

*Links on SpectraBase are not permalinks.
4-(Benzo[d]thiazol-2-yl)phenyl-2-cyano-3-(1,-3-diphenyl-1H-pyrazol-4-yl)propenoate
SpectraBase Compound ID LmWI0wowgtu
InChI InChI=1S/C32H20N4O2S/c33-20-24(19-25-21-36(26-11-5-2-6-12-26)35-30(25)22-9-3-1-4-10-22)32(37)38-27-17-15-23(16-18-27)31-34-28-13-7-8-14-29(28)39-31/h1-19,21H
InChIKey XBGKKHGCBZIDJR-UHFFFAOYSA-N
Mol Weight 524.6 g/mol
Molecular Formula C32H20N4O2S
Exact Mass 524.130697 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 9aZoAVUoh6Z
Name 4-(Benzo[d]thiazol-2-yl)phenyl-2-cyano-3-(1,-3-diphenyl-1H-pyrazol-4-yl)propenoate
Appearance Faint-green crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H20N4O2S
InChI InChI=1S/C32H20N4O2S/c33-20-24(19-25-21-36(26-11-5-2-6-12-26)35-30(25)22-9-3-1-4-10-22)32(37)38-27-17-15-23(16-18-27)31-34-28-13-7-8-14-29(28)39-31/h1-19,21H
InChIKey XBGKKHGCBZIDJR-UHFFFAOYSA-N
Instrument Name Thermo Scientific GCMS ISQ LT
Ionization Type EI
Literature Reference DOI 10.1002/jhet.4168
Molecular Weight 524.598 g/mol
SMILES c1cc2c(cc1)sc(n2)-c1ccc(cc1)OC(C(=Cc1c(n[n](c1)-c1ccccc1)-c1ccccc1)C#N)=O
SPLASH splash10-001i-1554910000-59c66c0e1faeecbc6e1c
Source of Spectrum Y-58-299-3
Wiley ID 1879305