| SpectraBase Spectrum ID |
74n8MsmNK4v |
| Name |
4H-1,3-Oxazin-4-one, 3-cyclohexyl-2-(cyclohexylimino)-6-(diphenylmethyl)-2,3-dihydro-5-phenyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
518.293328470 u |
| Formula |
C35H38N2O2 |
| InChI |
InChI=1S/C35H38N2O2/c38-34-32(28-20-10-3-11-21-28)33(31(26-16-6-1-7-17-26)27-18-8-2-9-19-27)39-35(36-29-22-12-4-13-23-29)37(34)30-24-14-5-15-25-30/h1-3,6-11,16-21,29-31H,4-5,12-15,22-25H2/b36-35- |
| InChIKey |
PZUGTIMLMPXWQE-KXYMVQBMSA-N |
| Molecular Weight |
518.701 g/mol |
| SMILES |
C=1(O\C(N(C(C1C=1C=CC=CC1)=O)C1CCCCC1)=N\C1CCCCC1)C(C=1C=CC=CC1)C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.949323 |
