SpectraBase Spectrum ID |
A4g2Xip33Go |
Name |
N-Z-L-Proline methyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
263.115758027 u |
Formula |
C14H17NO4 |
InChI |
InChI=1S/C14H17NO4/c1-18-13(16)12-8-5-9-15(12)14(17)19-10-11-6-3-2-4-7-11/h2-4,6-7,12H,5,8-10H2,1H3/t12-/m1/s1 |
InChIKey |
BLQYEDXWEDWCNJ-GFCCVEGCSA-N |
Molecular Weight |
263.293 g/mol |
SMILES |
C(N1[C@@](C(=O)OC)(CCC1)[H])(OCC=1C=CC=CC1)=O |
Spectrum/Structure Validation Score (Raman) |
0.989828 |