| SpectraBase Spectrum ID |
FpF7JNvHjWR |
| Name |
6-Benzamidohexanoic acid, ethyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
263.152143537 u |
| Formula |
C15H21NO3 |
| InChI |
InChI=1S/C15H21NO3/c1-2-19-14(17)11-7-4-8-12-16-15(18)13-9-5-3-6-10-13/h3,5-6,9-10H,2,4,7-8,11-12H2,1H3,(H,16,18) |
| InChIKey |
JXZTVZVTQRBNEN-UHFFFAOYSA-N |
| Molecular Weight |
263.337 g/mol |
| SMILES |
N(C(C1=CC=CC=C1)=O)CCCCCC(OCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95517 |
