| SpectraBase Spectrum ID |
Kc3tSwoPUKU |
| Name |
11,11-Dimethyl-5-methyl-5,6-dihydro-11H-dibenzo[B,E]azepin-6-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
283.120843408 u |
| Formula |
C17H17NO3 |
| InChI |
InChI=1S/C17H17NO3/c1-18-15-11-7-6-10-14(15)17(20-2,21-3)13-9-5-4-8-12(13)16(18)19/h4-11H,1-3H3 |
| InChIKey |
LLNBCRIPUSNMNT-UHFFFAOYSA-N |
| SMILES |
C1(C=2C(N(C)C(C=3C1=CC=CC3)=O)=CC=CC2)(OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.821609 |