| SpectraBase Spectrum ID |
1rYWSxxtqr4 |
| Name |
N-Methyl-N-iso-propyl-1-(2,3-methylenedioxyphenyl)butan-2-amine |
| 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/c1-5-13(16(4)11(2)3)9-12-7-6-8-14-15(12)18-10-17-14/h6-8,11,13H,5,9-10H2,1-4H3 |
| InChIKey |
UYSDPYZJNWHFQD-UHFFFAOYSA-N |
| Molecular Weight |
249.354 g/mol |
| SMILES |
C1=2C(CC(N(C(C)C)C)CC)=CC=CC2OCO1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.855492 |
