SpectraBase Spectrum ID |
ADu620Ywtyl |
Name |
Valeramide, 2-methyl-N-(2-phenylethyl)-N-tetradecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
415.381415201 u |
Formula |
C28H49NO |
InChI |
InChI=1S/C28H49NO/c1-4-6-7-8-9-10-11-12-13-14-15-19-24-29(28(30)26(3)20-5-2)25-23-27-21-17-16-18-22-27/h16-18,21-22,26H,4-15,19-20,23-25H2,1-3H3 |
InChIKey |
ALOYJEJWLWEQLZ-UHFFFAOYSA-N |
Molecular Weight |
415.706 g/mol |
SMILES |
C1=CC=CC(=C1)CCN(C(=O)C(CCC)C)CCCCCCCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.903123 |