| SpectraBase Spectrum ID |
6fzKCxrMFuj |
| Name |
2-[[2-(Tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]acetic acid methyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.168521876 u |
| Formula |
C17H24N2O5 |
| InChI |
InChI=1S/C17H24N2O5/c1-17(2,3)24-16(22)19-13(10-12-8-6-5-7-9-12)15(21)18-11-14(20)23-4/h5-9,13H,10-11H2,1-4H3,(H,18,21)(H,19,22) |
| InChIKey |
KRYDBLGWCUNDCJ-UHFFFAOYSA-N |
| Molecular Weight |
336.388 g/mol |
| SMILES |
N(C(OC(C)(C)C)=O)C(C(=O)NCC(=O)OC)Cc1ccccc1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.945037 |
![2-[[2-(Tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]acetic acid methyl ester](/api/spectrum/6fzKCxrMFuj/structure.png?h=300&w=458 "2-[[2-(Tert-butoxycarbonylamino)-3-phenyl-propanoyl]amino]acetic acid methyl ester")
