SpectraBase Spectrum ID |
2avTHSUTkhu |
Name |
Benzamide, 3-ethyl-N-(2-phenylethyl)-N-hexyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
337.240564621 u |
Formula |
C23H31NO |
InChI |
InChI=1S/C23H31NO/c1-3-5-6-10-17-24(18-16-21-12-8-7-9-13-21)23(25)22-15-11-14-20(4-2)19-22/h7-9,11-15,19H,3-6,10,16-18H2,1-2H3 |
InChIKey |
LJGDATKFZWXGGZ-UHFFFAOYSA-N |
Molecular Weight |
337.507 g/mol |
SMILES |
C1=CC=CC(=C1)CCN(C(=O)C=1C=CC=C(CC)C1)CCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967559 |