| SpectraBase Spectrum ID |
H2kFXlYXchW |
| Name |
10H-Dibenzo[B,F][1,4]oxazepin-11-one, 3-benzylsulfanyl-1-nitro- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
378.067428109 u |
| Formula |
C20H14N2O4S |
| InChI |
InChI=1S/C20H14N2O4S/c23-20-19-16(22(24)25)10-14(27-12-13-6-2-1-3-7-13)11-18(19)26-17-9-5-4-8-15(17)21-20/h1-11H,12H2,(H,21,23) |
| InChIKey |
WJKXPRPIIHNTMY-UHFFFAOYSA-N |
| Molecular Weight |
378.402 g/mol |
| SMILES |
C=12C(NC3=CC=CC=C3OC2=CC(=CC1N(=O)=O)SCC1=CC=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908828 |
![10H-Dibenzo[b,f][1,4]oxazepin-11-one, 3-benzylsulfanyl-1-nitro-](/api/spectrum/H2kFXlYXchW/structure.png?h=300&w=458 "10H-Dibenzo[b,f][1,4]oxazepin-11-one, 3-benzylsulfanyl-1-nitro-")
