SpectraBase Spectrum ID |
CWCdVUCFkNB |
Name |
1-(4-Methoxy-3-methylphenyl)-N-methylpropan-2-amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
193.146664235 u |
Formula |
C12H19NO |
InChI |
InChI=1S/C12H19NO/c1-9-7-11(8-10(2)13-3)5-6-12(9)14-4/h5-7,10,13H,8H2,1-4H3 |
InChIKey |
QSPIGUCMJZPIGM-UHFFFAOYSA-N |
Molecular Weight |
193.290 g/mol |
SMILES |
C1=C(C(=CC(=C1)CC(NC)C)C)OC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.972405 |