| SpectraBase Spectrum ID |
3XVoYGnfMIh |
| Name |
7-(1,3-Diphenyl-1H-pyrazol-4-yl)-5-hydroxy-2-(thiophen-2-yl)-1,3,4-oxadiazepine-6-carbonitrile |
| Appearance |
Beige crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C24H15N5O2S |
| InChI |
InChI=1S/C24H15N5O2S/c25-14-18-22(31-24(27-26-23(18)30)20-12-7-13-32-20)19-15-29(17-10-5-2-6-11-17)28-21(19)16-8-3-1-4-9-16/h1-13,15H,(H,26,30) |
| InChIKey |
GPPGGKFGRJLHGN-UHFFFAOYSA-N |
| Instrument Name |
Thermo Scientific GCMS ISQ LT |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.4168 |
| Molecular Weight |
437.477 g/mol |
| SMILES |
OC1=NN=C(OC(=C1C#N)c1c[n](-c2ccccc2)nc1-c1ccccc1)c1cccs1 |
| SPLASH |
splash10-03l0-3396400000-489775dfd05b2b71f069 |
| Source of Spectrum |
Y-58-300-16 |
| Wiley ID |
1879301 |
