| SpectraBase Spectrum ID |
H7Mg3UMvOeb |
| Name |
Methyl (E)-1-[2'-(methoxycarbonyl)-3'-phenylallyl]-aziridine-2-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
275.115758027 u |
| Formula |
C15H17NO4 |
| InChI |
InChI=1S/C15H17NO4/c1-19-14(17)12(8-11-6-4-3-5-7-11)9-16-10-13(16)15(18)20-2/h3-8,13H,9-10H2,1-2H3/b12-8+ |
| InChIKey |
JDBALGFROKMALJ-XYOKQWHBSA-N |
| SMILES |
C1(N(C1)C\C(C(=O)OC)=C/C1=CC=CC=C1)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.970489 |
![Methyl (E)-1-[2'-(methoxycarbonyl)-3'-phenylallyl]-aziridine-2-carboxylate](/api/spectrum/H7Mg3UMvOeb/structure.png?h=300&w=458 "Methyl (E)-1-[2'-(methoxycarbonyl)-3'-phenylallyl]-aziridine-2-carboxylate")
