| SpectraBase Spectrum ID |
JsYHgKqjxjq |
| Name |
N-(2,6-Dimethylphenyl)-3-oxo-4-phenethyl-2,3,4,5-tetrahydrobenzo[F][1,4]oxazepine-5-carboxamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
414.194342702 u |
| Formula |
C26H26N2O3 |
| InChI |
InChI=1S/C26H26N2O3/c1-18-9-8-10-19(2)24(18)27-26(30)25-21-13-6-7-14-22(21)31-17-23(29)28(25)16-15-20-11-4-3-5-12-20/h3-14,25H,15-17H2,1-2H3,(H,27,30) |
| InChIKey |
AXFDZHBDJOEPQH-UHFFFAOYSA-N |
| Molecular Weight |
414.505 g/mol |
| SMILES |
C1OC=2C(C(N(C1=O)CCC1=CC=CC=C1)C(=O)NC1=C(C=CC=C1C)C)=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.963777 |
![N-(2,6-Dimethylphenyl)-3-oxo-4-phenethyl-2,3,4,5-tetrahydrobenzo[F][1,4]oxazepine-5-carboxamide](/api/spectrum/JsYHgKqjxjq/structure.png?h=300&w=458 "N-(2,6-Dimethylphenyl)-3-oxo-4-phenethyl-2,3,4,5-tetrahydrobenzo[F][1,4]oxazepine-5-carboxamide")
