| SpectraBase Spectrum ID |
3DybdZ8FeC |
| Name |
N-Pentanoyl-N-phenylpentanamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
261.172878983 u |
| Formula |
C16H23NO2 |
| InChI |
InChI=1S/C16H23NO2/c1-3-5-12-15(18)17(16(19)13-6-4-2)14-10-8-7-9-11-14/h7-11H,3-6,12-13H2,1-2H3 |
| InChIKey |
KUSFXMRAUSUVTR-UHFFFAOYSA-N |
| Molecular Weight |
261.365 g/mol |
| SMILES |
C=1(N(C(CCCC)=O)C(CCCC)=O)C=CC=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.918031 |
