| SpectraBase Spectrum ID |
I2YZPqK8UFT |
| Name |
L-Leucine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, pentyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
371.303558800 u |
| Formula |
C21H41NO4 |
| InChI |
InChI=1S/C21H41NO4/c1-7-10-12-14-25-20(23)19(15-17(4)5)22(6)21(24)26-16-18(9-3)13-11-8-2/h17-19H,7-16H2,1-6H3 |
| InChIKey |
SQULXEDUAOYLSP-UHFFFAOYSA-N |
| Molecular Weight |
371.562 g/mol |
| SMILES |
C(C)(C)CC(N(C)C(=O)OCC(CCCC)CC)C(OCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.867998 |
