SpectraBase Spectrum ID |
J2UcBwyWBQ4 |
Name |
Benzamide, 2-methyl-N-propyl-N-undecyl- |
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/c1-4-6-7-8-9-10-11-12-15-19-23(18-5-2)22(24)21-17-14-13-16-20(21)3/h13-14,16-17H,4-12,15,18-19H2,1-3H3 |
InChIKey |
VYSJBCUFCJBPKO-UHFFFAOYSA-N |
Molecular Weight |
331.544 g/mol |
SMILES |
C(C1=CC=CC=C1C)(N(CCCCCCCCCCC)CCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.939289 |