SpectraBase Spectrum ID |
8lRypjZoBbT |
Name |
Benzamide, 4-butyl-N-allyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
217.146664235 u |
Formula |
C14H19NO |
InChI |
InChI=1S/C14H19NO/c1-3-5-6-12-7-9-13(10-8-12)14(16)15-11-4-2/h4,7-10H,2-3,5-6,11H2,1H3,(H,15,16) |
InChIKey |
XHVWYVBMZWNMKY-UHFFFAOYSA-N |
Molecular Weight |
217.312 g/mol |
SMILES |
C1(=CC=C(C=C1)CCCC)C(=O)NCC=C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.847857 |