SpectraBase Spectrum ID |
2WvQaEhxGHb |
Name |
3'-Methoxy-2-(N-methyl,N-propylamino)acetophenone |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
221.141578854 u |
Formula |
C13H19NO2 |
InChI |
InChI=1S/C13H19NO2/c1-4-8-14(2)10-13(15)11-6-5-7-12(9-11)16-3/h5-7,9H,4,8,10H2,1-3H3 |
InChIKey |
USKUKVVAZBUQCQ-UHFFFAOYSA-N |
Molecular Weight |
221.300 g/mol |
SMILES |
C=1(C(CN(CCC)C)=O)C=C(C=CC1)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.889045 |