| SpectraBase Spectrum ID |
Dcok4zG1QCh |
| Name |
N,N-Dimethyl-1-(3,4-methylenedioxyphenyl)butan-2-amine |
| 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/c1-4-11(14(2)3)7-10-5-6-12-13(8-10)16-9-15-12/h5-6,8,11H,4,7,9H2,1-3H3 |
| InChIKey |
CQFYHEHMIQICOL-UHFFFAOYSA-N |
| Molecular Weight |
221.300 g/mol |
| SMILES |
C1=2C(=CC=C(C2)CC(N(C)C)CC)OCO1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.922668 |
