SpectraBase Spectrum ID |
5xVx9ilQWo7 |
Name |
Methyl 3-[N-methyl-N-(trans-2-phenylcyclopropyl)amino]propanoate |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
233.141578854 u |
Formula |
C14H19NO2 |
InChI |
InChI=1S/C14H19NO2/c1-15(9-8-14(16)17-2)13-10-12(13)11-6-4-3-5-7-11/h3-7,12-13H,8-10H2,1-2H3 |
InChIKey |
VVMNARFHWBKUSE-UHFFFAOYSA-N |
Molecular Weight |
233.311 g/mol |
SMILES |
C1(C(C2=CC=CC=C2)C1)N(CCC(=O)OC)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.845392 |