| SpectraBase Spectrum ID |
2LMp2FvruX |
| Name |
Ethyl 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 |
247.157228918 u |
| Formula |
C15H21NO2 |
| InChI |
InChI=1S/C15H21NO2/c1-3-18-15(17)9-10-16(2)14-11-13(14)12-7-5-4-6-8-12/h4-8,13-14H,3,9-11H2,1-2H3/t13-,14+/m0/s1 |
| InChIKey |
CPNDKLRSYBSAOC-UONOGXRCSA-N |
| Molecular Weight |
247.338 g/mol |
| SMILES |
[C@]1([C@](C2=CC=CC=C2)(C1)[H])(N(CCC(=O)OCC)C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.834512 |
![Ethyl 3-[N-methyl-N-(trans-2'-phenylcyclopropyl)amino]propanoate](/api/spectrum/2LMp2FvruX/structure.png?h=300&w=458 "Ethyl 3-[N-methyl-N-(trans-2'-phenylcyclopropyl)amino]propanoate")
