| SpectraBase Spectrum ID |
FNq6Ey6wZSX |
| Name |
4H-Azepin-4-one, hexahydro-1,2-diphenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
265.146664235 u |
| Formula |
C18H19NO |
| InChI |
InChI=1S/C18H19NO/c20-17-12-7-13-19(16-10-5-2-6-11-16)18(14-17)15-8-3-1-4-9-15/h1-6,8-11,18H,7,12-14H2 |
| InChIKey |
RGZXQWWFEDCJSJ-UHFFFAOYSA-N |
| Molecular Weight |
265.356 g/mol |
| SMILES |
C1(N(CCCC(C1)=O)C=1C=CC=CC1)C1=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889733 |
