SpectraBase Compound ID | IdAZxpY9iUQ |
---|---|
InChI | InChI=1S/C9H15NO4/c1-4-6-14-9(12)10(3)7-8(11)13-5-2/h4H,1,5-7H2,2-3H3 |
InChIKey | YEMXMCZWBCOZQF-UHFFFAOYSA-N |
Mol Weight | 201.22 g/mol |
Molecular Formula | C9H15NO4 |
Exact Mass | 201.100108 g/mol |
SpectraBase Spectrum ID | 9GbWhVnEzB9 |
---|---|
Name | Glycine, N-methyl-N-allyloxycarbonyl-, ethyl ester |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 201.100107963 u |
Formula | C9H15NO4 |
InChI | InChI=1S/C9H15NO4/c1-4-6-14-9(12)10(3)7-8(11)13-5-2/h4H,1,5-7H2,2-3H3 |
InChIKey | YEMXMCZWBCOZQF-UHFFFAOYSA-N |
Molecular Weight | 201.222 g/mol |
SMILES | C=CCOC(N(C)CC(OCC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.961263 |