SpectraBase Spectrum ID |
KPqeGlsCuvs |
Name |
Benzamide, 3-methoxy-N-(2-butyl)-N-heptyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
305.235479240 u |
Formula |
C19H31NO2 |
InChI |
InChI=1S/C19H31NO2/c1-5-7-8-9-10-14-20(16(3)6-2)19(21)17-12-11-13-18(15-17)22-4/h11-13,15-16H,5-10,14H2,1-4H3 |
InChIKey |
RUUAFIYUIGMQPE-UHFFFAOYSA-N |
Molecular Weight |
305.462 g/mol |
SMILES |
C(N(CCCCCCC)C(CC)C)(=O)C=1C=C(C=CC1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842851 |