| SpectraBase Spectrum ID |
H2TcpFT4aiY |
| Name |
Glycine, N-methyl-N-isobutoxycarbonyl-, butyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
245.162708221 u |
| Formula |
C12H23NO4 |
| InChI |
InChI=1S/C12H23NO4/c1-5-6-7-16-11(14)8-13(4)12(15)17-9-10(2)3/h10H,5-9H2,1-4H3 |
| InChIKey |
VPKJATUXDYDZRD-UHFFFAOYSA-N |
| Molecular Weight |
245.319 g/mol |
| SMILES |
CC(C)COC(N(CC(OCCCC)=O)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.844365 |
