| SpectraBase Spectrum ID |
EFVTSlXTTxx |
| Name |
Methyl (1S,2R)-(+)-1-[N-(benzyloxycarbonyl)amino]-2-methoxycarbonylmethylcyclopropanecarboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
321.121237330 u |
| Formula |
C16H19NO6 |
| InChI |
InChI=1S/C16H19NO6/c1-21-13(18)8-12-9-16(12,14(19)22-2)17-15(20)23-10-11-6-4-3-5-7-11/h3-7,12H,8-10H2,1-2H3,(H,17,20)/t12-,16-/m0/s1 |
| InChIKey |
XUIAXBLGSGWBAQ-LRDDRELGSA-N |
| Molecular Weight |
321.329 g/mol |
| SMILES |
[C@@]1([C@@](CC(=O)OC)(C1)[H])(NC(=O)OCC1=CC=CC=C1)C(=O)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.980552 |
![Methyl (1S,2R)-(+)-1-[N-(benzyloxycarbonyl)amino]-2-methoxycarbonylmethylcyclopropanecarboxylate](/api/spectrum/EFVTSlXTTxx/structure.png?h=300&w=458 "Methyl (1S,2R)-(+)-1-[N-(benzyloxycarbonyl)amino]-2-methoxycarbonylmethylcyclopropanecarboxylate")
