| SpectraBase Spectrum ID |
8aTHvfbFODC |
| Name |
1H-1,4-Benzodiazepin-2(3H)-one, 3-methyl-5-phenyl-7-nitro- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
295.095691288 u |
| Formula |
C16H13N3O3 |
| InChI |
InChI=1S/C16H13N3O3/c1-10-16(20)18-14-8-7-12(19(21)22)9-13(14)15(17-10)11-5-3-2-4-6-11/h2-10H,1H3,(H,18,20) |
| InChIKey |
PRMIWZTXQDCXCT-UHFFFAOYSA-N |
| Molecular Weight |
295.298 g/mol |
| SMILES |
C1(N(=O)=O)=CC=C2C(C(C3=CC=CC=C3)=NC(C)C(=O)N2)=C1 |
