SpectraBase Spectrum ID |
7eQBJ74BA69 |
Name |
Ciclotizolam |
Source of Sample |
Cayman Chemical Company |
Catalog Number |
37999 |
Lot Number |
0668803-4 |
Accessory |
DurasamplIR II |
CAS Registry Number |
58765-21-2 |
Copyright |
Copyright © 2019-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
460.012408470 u |
Formula |
C20H18BrClN4S |
InChI |
InChI=1S/C20H18BrClN4S/c21-16-10-14-18(13-8-4-5-9-15(13)22)23-11-17-24-25-19(26(17)20(14)27-16)12-6-2-1-3-7-12/h4-5,8-10,12H,1-3,6-7,11H2 |
InChIKey |
ZOSHXIXUCKESEG-UHFFFAOYSA-N |
Instrument Name |
Bio-Rad FTS |
Molecular Weight |
461.809 g/mol |
Purity |
≥98% |
Resolution |
4 |
SMILES |
C=12N(C3=C(C(=NC2)C=2C(=CC=CC2)Cl)C=C(S3)Br)C(=NN1)C1CCCCC1 |
Scan Speed (number) |
5 |
Source of Spectrum |
Forensic Spectral Research |
Synonyms |
2-bromo-4-(2-chlorophenyl)-9-cyclohexyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine
WE-973 |
Technique |
ATR-Neat |