SpectraBase Spectrum ID |
96xXzsb1RcA |
Name |
Butyramide, 4-(4-methoxyphenyl)-N-propyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
235.157228918 u |
Formula |
C14H21NO2 |
InChI |
InChI=1S/C14H21NO2/c1-3-11-15-14(16)6-4-5-12-7-9-13(17-2)10-8-12/h7-10H,3-6,11H2,1-2H3,(H,15,16) |
InChIKey |
NKZJJUQNYFQJGA-UHFFFAOYSA-N |
Molecular Weight |
235.327 g/mol |
SMILES |
C(C(=O)NCCC)CCC1=CC=C(OC)C=C1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.946776 |