SpectraBase Spectrum ID |
3G2EoV7zhfZ |
Name |
Benzamide, 4-methyl-N-(2-butyl)-N-decyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
331.287514814 u |
Formula |
C22H37NO |
InChI |
InChI=1S/C22H37NO/c1-5-7-8-9-10-11-12-13-18-23(20(4)6-2)22(24)21-16-14-19(3)15-17-21/h14-17,20H,5-13,18H2,1-4H3 |
InChIKey |
QFNPQOMHBFSOAO-UHFFFAOYSA-N |
Molecular Weight |
331.544 g/mol |
SMILES |
C(N(CCCCCCCCCC)C(CC)C)(=O)C=1C=CC(=CC1)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.870261 |