| SpectraBase Spectrum ID |
AANkTSEjAmI |
| Name |
Acetic acid N'-[2-(7-bromo-2-oxo-5-phenyl-2,3-dihydro-benzo[E][1,4]diazepin-1-yl)-acetyl]-hydrazide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
428.048403420 u |
| Formula |
C19H17BrN4O3 |
| InChI |
InChI=1S/C19H17BrN4O3/c1-12(25)22-23-17(26)11-24-16-8-7-14(20)9-15(16)19(21-10-18(24)27)13-5-3-2-4-6-13/h2-9H,10-11H2,1H3,(H,22,25)(H,23,26) |
| InChIKey |
MCEBWJSYSMPHGK-UHFFFAOYSA-N |
| Molecular Weight |
429.274 g/mol |
| SMILES |
C1=2N(C(CN=C(C2C=C(Br)C=C1)C1=CC=CC=C1)=O)CC(NNC(=O)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92522 |
![Acetic acid N'-[2-(7-bromo-2-oxo-5-phenyl-2,3-dihydro-benzo[E][1,4]diazepin-1-yl)-acetyl]-hydrazide](/api/spectrum/AANkTSEjAmI/structure.png?h=300&w=458 "Acetic acid N'-[2-(7-bromo-2-oxo-5-phenyl-2,3-dihydro-benzo[E][1,4]diazepin-1-yl)-acetyl]-hydrazide")
