SpectraBase Spectrum ID |
IY4UpX3EehO |
Name |
Valeramide, 2-methyl-N-tetradecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
311.318814943 u |
Formula |
C20H41NO |
InChI |
InChI=1S/C20H41NO/c1-4-6-7-8-9-10-11-12-13-14-15-16-18-21-20(22)19(3)17-5-2/h19H,4-18H2,1-3H3,(H,21,22) |
InChIKey |
UXBHDMBYLZFQJS-UHFFFAOYSA-N |
Molecular Weight |
311.554 g/mol |
SMILES |
C(=O)(NCCCCCCCCCCCCCC)C(CCC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.905706 |