| SpectraBase Spectrum ID |
GokmjMeHi1R |
| Name |
1-Ethyl-1,2,3,4-tetrahydro-8-methyl-6-phenyl-1,5-benzodiazocin-2-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
292.157563271 u |
| Formula |
C19H20N2O |
| InChI |
InChI=1S/C19H20N2O/c1-3-21-17-10-9-14(2)13-16(17)19(20-12-11-18(21)22)15-7-5-4-6-8-15/h4-10,13H,3,11-12H2,1-2H3/b20-19- |
| InChIKey |
PJJCITGRURDNGV-VXPUYCOJSA-N |
| SMILES |
C1C\N=C/(C2=C(N(C1=O)CC)C=CC(=C2)C)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913039 |
