SpectraBase Spectrum ID |
494lB0xHS6l |
Name |
Valeramide, 5-phenyl-N-decyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
317.271864750 u |
Formula |
C21H35NO |
InChI |
InChI=1S/C21H35NO/c1-2-3-4-5-6-7-8-14-19-22-21(23)18-13-12-17-20-15-10-9-11-16-20/h9-11,15-16H,2-8,12-14,17-19H2,1H3,(H,22,23) |
InChIKey |
SUOCEKJWEDWQCQ-UHFFFAOYSA-N |
Molecular Weight |
317.517 g/mol |
SMILES |
C(=O)(NCCCCCCCCCC)CCCCC1=CC=CC=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955051 |