SpectraBase Spectrum ID |
3qvgW0H1JEw |
Name |
N-(1-(4-Methoxy-3-methylphenyl)propan-2-yl)-N-methylpropionamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
249.172878983 u |
Formula |
C15H23NO2 |
InChI |
InChI=1S/C15H23NO2/c1-6-15(17)16(4)12(3)10-13-7-8-14(18-5)11(2)9-13/h7-9,12H,6,10H2,1-5H3 |
InChIKey |
MDBOCEMSTDYAEB-UHFFFAOYSA-N |
Molecular Weight |
249.354 g/mol |
SMILES |
C1=C(C(=CC(=C1)CC(N(C(CC)=O)C)C)C)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.931857 |