SpectraBase Spectrum ID |
GF1fMZgfOpf |
Name |
Glycine, N-propoxycarbonyl-, isobutyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
217.131408092 u |
Formula |
C10H19NO4 |
InChI |
InChI=1S/C10H19NO4/c1-4-5-14-10(13)11-6-9(12)15-7-8(2)3/h8H,4-7H2,1-3H3,(H,11,13) |
InChIKey |
HATUPLIOMYBIKM-UHFFFAOYSA-N |
Molecular Weight |
217.265 g/mol |
SMILES |
CCCOC(NCC(OCC(C)C)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914636 |