| SpectraBase Spectrum ID |
24YAn3VhERW |
| Name |
1H-1-Benzazepine-1-pentanoic acid, 2,3,4,5-tetrahydro-.beta.,.beta.-dimethyl-.delta.-oxo- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
289.167793602 u |
| Formula |
C17H23NO3 |
| InChI |
InChI=1S/C17H23NO3/c1-17(2,12-16(20)21)11-15(19)18-10-6-5-8-13-7-3-4-9-14(13)18/h3-4,7,9H,5-6,8,10-12H2,1-2H3,(H,20,21) |
| InChIKey |
JJRXSJFAOPYJOK-UHFFFAOYSA-N |
| SMILES |
C1=CC=C2N(C(CC(CC(=O)O)(C)C)=O)CCCCC2=C1 |
