SpectraBase Spectrum ID |
IhaMAUzo6rW |
Name |
Glycine, N-ethyl-N-allyloxycarbonyl-, butyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
243.147058156 u |
Formula |
C12H21NO4 |
InChI |
InChI=1S/C12H21NO4/c1-4-7-9-16-11(14)10-13(6-3)12(15)17-8-5-2/h5H,2,4,6-10H2,1,3H3 |
InChIKey |
GVXBNMQEWLTMIZ-UHFFFAOYSA-N |
Molecular Weight |
243.303 g/mol |
SMILES |
C(CN(C(OCC=C)=O)CC)(OCCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839458 |