| SpectraBase Spectrum ID |
9wIDLL6LLXG |
| Name |
2-Methyl-4-(4'-methylphenyl)-1,2-dihydro-3H-2-benzazepin-3-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
263.131014170 u |
| Formula |
C18H17NO |
| InChI |
InChI=1S/C18H17NO/c1-13-7-9-14(10-8-13)17-11-15-5-3-4-6-16(15)12-19(2)18(17)20/h3-11H,12H2,1-2H3 |
| InChIKey |
FHTSTNVBNFNNMC-UHFFFAOYSA-N |
| Molecular Weight |
263.340 g/mol |
| SMILES |
C1N(C(C(=CC=2C1=CC=CC2)C1=CC=C(C=C1)C)=O)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.845391 |
