| SpectraBase Spectrum ID |
KsbQCukajBq |
| Name |
L-Allylglycine, N-butoxycarbonyl-, pentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
285.194008349 u |
| Formula |
C15H27NO4 |
| InChI |
InChI=1S/C15H27NO4/c1-4-7-9-12-19-14(17)13(10-6-3)16-15(18)20-11-8-5-2/h6,13H,3-5,7-12H2,1-2H3,(H,16,18) |
| InChIKey |
LHDHAHSEBIJEBL-UHFFFAOYSA-N |
| SMILES |
CCCCCOC(C(NC(OCCCC)=O)CC=C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.897951 |
