| SpectraBase Spectrum ID |
Iq3e1puZCJ3 |
| Name |
4-Benzyl-N-(2,6-dimethylphenyl)-3-oxo-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 |
400.178692638 u |
| Formula |
C25H24N2O3 |
| InChI |
InChI=1S/C25H24N2O3/c1-17-9-8-10-18(2)23(17)26-25(29)24-20-13-6-7-14-21(20)30-16-22(28)27(24)15-19-11-4-3-5-12-19/h3-14,24H,15-16H2,1-2H3,(H,26,29) |
| InChIKey |
ORCULEGJWJQIRC-UHFFFAOYSA-N |
| Molecular Weight |
400.478 g/mol |
| SMILES |
C1OC=2C(C(N(C1=O)CC1=CC=CC=C1)C(=O)NC1=C(C=CC=C1C)C)=CC=CC2 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95337 |
![4-Benzyl-N-(2,6-dimethylphenyl)-3-oxo-2,3,4,5-tetrahydrobenzo[F][1,4]oxazepine-5-carboxamide](/api/spectrum/Iq3e1puZCJ3/structure.png?h=300&w=458 "4-Benzyl-N-(2,6-dimethylphenyl)-3-oxo-2,3,4,5-tetrahydrobenzo[F][1,4]oxazepine-5-carboxamide")
