SpectraBase Spectrum ID |
D4jSpZeJ3cx |
Name |
dl-Norleucine, N-allyloxycarbonyl-, butyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
271.178358285 u |
Formula |
C14H25NO4 |
InChI |
InChI=1S/C14H25NO4/c1-4-7-9-12(13(16)18-11-8-5-2)15-14(17)19-10-6-3/h6,12H,3-5,7-11H2,1-2H3,(H,15,17) |
InChIKey |
RFQHABBCSIPAGU-UHFFFAOYSA-N |
Molecular Weight |
271.357 g/mol |
SMILES |
C(OCC=C)(NC(C(=O)OCCCC)CCCC)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.859713 |