| SpectraBase Spectrum ID |
CRSW7Q5EqEy |
| Name |
4'-Chloro-2-[5-(alpha,alpha,alpha-trifluoro-m-tolyl)-2H-tetrazol-2-yl]acetophenone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
366.049523146 u |
| Formula |
C16H10ClF3N4O |
| InChI |
InChI=1S/C16H10ClF3N4O/c17-13-6-4-10(5-7-13)14(25)9-24-22-15(21-23-24)11-2-1-3-12(8-11)16(18,19)20/h1-8H,9H2 |
| InChIKey |
XJHNKLIDDAUPPL-UHFFFAOYSA-N |
| Molecular Weight |
366.731 g/mol |
| SMILES |
C(F)(F)(F)C=1C=CC=C(C1)C1=NN(N=N1)CC(C=1C=CC(=CC1)Cl)=O |
![4'-chloro-2-[5-(alpha,alpha,alpha-trifluoro-m-tolyl)-2H-tetrazol-2-yl]acetophenone](/api/spectrum/CRSW7Q5EqEy/structure.png?h=300&w=458 "4'-chloro-2-[5-(alpha,alpha,alpha-trifluoro-m-tolyl)-2H-tetrazol-2-yl]acetophenone")
