SpectraBase Spectrum ID |
IPEoXMCCNRQ |
Name |
2-Methyl-2-(3,4-methylenedioxyphenyl)propan-1-amine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
193.110278725 u |
Formula |
C11H15NO2 |
InChI |
InChI=1S/C11H15NO2/c1-11(2,6-12)8-3-4-9-10(5-8)14-7-13-9/h3-5H,6-7,12H2,1-2H3 |
InChIKey |
CGZCCWRCOLWZKV-UHFFFAOYSA-N |
Molecular Weight |
193.246 g/mol |
SMILES |
C(C=1C=C2C(=CC1)OCO2)(CN)(C)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.979912 |