| SpectraBase Spectrum ID |
KMeKCZiuZKy |
| Name |
6H-1,4-Diazepin-6-one, 2,3-dihydro-5,7-dimethyl-, 4-bromophenylhydrazone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
306.048009499 u |
| Formula |
C13H15BrN4 |
| InChI |
InChI=1S/C13H15BrN4/c1-9-13(10(2)16-8-7-15-9)18-17-12-5-3-11(14)4-6-12/h3-6,17H,7-8H2,1-2H3 |
| InChIKey |
PHWHCOBHZQWKRJ-UHFFFAOYSA-N |
| Molecular Weight |
307.195 g/mol |
| SMILES |
C1N=C(C(C(=NC1)C)=NNC1=CC=C(C=C1)Br)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92121 |
