SpectraBase Spectrum ID |
IkRNBuX8Tpt |
Name |
Glycine, N-methyl-N-butoxycarbonyl-, pentyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
259.178358285 u |
Formula |
C13H25NO4 |
InChI |
InChI=1S/C13H25NO4/c1-4-6-8-10-17-12(15)11-14(3)13(16)18-9-7-5-2/h4-11H2,1-3H3 |
InChIKey |
YLTXWCDIDPJYQF-UHFFFAOYSA-N |
Molecular Weight |
259.346 g/mol |
SMILES |
CCCCOC(N(C)CC(OCCCCC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95214 |