| SpectraBase Spectrum ID |
G4SvNinnyp3 |
| Name |
12,13-Dihydro-5-methyl-3-nitro-5H-[3]benzazepino[3,2-A]quinoxalin-6-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
321.111341352 u |
| Formula |
C18H15N3O3 |
| InChI |
InChI=1S/C18H15N3O3/c1-19-16-11-14(21(23)24)6-7-15(16)20-9-8-12-4-2-3-5-13(12)10-17(20)18(19)22/h2-7,10-11H,8-9H2,1H3 |
| InChIKey |
HNTASGMNJXTQFR-UHFFFAOYSA-N |
| Molecular Weight |
321.336 g/mol |
| SMILES |
C=12N(C=3C=CC(=CC3N(C2=O)C)N(=O)=O)CCC=2C(C1)=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.93412 |
![12,13-Dihydro-5-methyl-3-nitro-5H-[3]benzazepino[3,2-a]quinoxalin-6-one](/api/spectrum/G4SvNinnyp3/structure.png?h=300&w=458 "12,13-Dihydro-5-methyl-3-nitro-5H-[3]benzazepino[3,2-a]quinoxalin-6-one")
