SpectraBase Spectrum ID |
65Gp4nPIpHi |
Name |
N-Benzyl-3-oxo-4-(pyridin-3-ylmethyl)-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 |
387.158291545 u |
Formula |
C23H21N3O3 |
InChI |
InChI=1S/C23H21N3O3/c27-21-16-29-20-11-5-4-10-19(20)22(26(21)15-18-9-6-12-24-13-18)23(28)25-14-17-7-2-1-3-8-17/h1-13,22H,14-16H2,(H,25,28) |
InChIKey |
FKFQCKLVHPHRKZ-UHFFFAOYSA-N |
Molecular Weight |
387.439 g/mol |
SMILES |
C1OC=2C(C(N(C1=O)CC1=CN=CC=C1)C(=O)NCC1=CC=CC=C1)=CC=CC2 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.920403 |