SpectraBase Spectrum ID |
1tAnSEb2U4r |
Name |
Benzamide, 3-methoxy-N-(2-butyl)-N-pentyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
277.204179111 u |
Formula |
C17H27NO2 |
InChI |
InChI=1S/C17H27NO2/c1-5-7-8-12-18(14(3)6-2)17(19)15-10-9-11-16(13-15)20-4/h9-11,13-14H,5-8,12H2,1-4H3 |
InChIKey |
GKEJUOGFYMUKIZ-UHFFFAOYSA-N |
Molecular Weight |
277.408 g/mol |
SMILES |
C(N(CCCCC)C(CC)C)(=O)C=1C=C(C=CC1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.840424 |