| SpectraBase Spectrum ID |
JFjOVwTvM2y |
| Name |
Methyl 2-{(1S)-1-[(tert-butoxy)carbonylamino]-2-phenylethyl}-(2Z)-3-(4-methoxyphenyl)prop-2-enoate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
411.204573033 u |
| Formula |
C24H29NO5 |
| InChI |
InChI=1S/C24H29NO5/c1-24(2,3)30-23(27)25-21(16-17-9-7-6-8-10-17)20(22(26)29-5)15-18-11-13-19(28-4)14-12-18/h6-15,21H,16H2,1-5H3,(H,25,27)/b20-15-/t21-/m0/s1 |
| InChIKey |
CQPBUUGSPAUJPT-LDVBQKTRSA-N |
| Molecular Weight |
411.498 g/mol |
| SMILES |
[C@@](\C(C(=O)OC)=C\C=1C=CC(=CC1)OC)(NC(OC(C)(C)C)=O)(CC1=CC=CC=C1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.815106 |
![Methyl 2-{(1S)-1-[(tert-butoxy)carbonylamino]-2-phenylethyl}-(2Z)-3-(4-methoxyphenyl)prop-2-enoate](/api/spectrum/JFjOVwTvM2y/structure.png?h=300&w=458 "Methyl 2-{(1S)-1-[(tert-butoxy)carbonylamino]-2-phenylethyl}-(2Z)-3-(4-methoxyphenyl)prop-2-enoate")
