| SpectraBase Spectrum ID |
DIyvOJUg4Jn |
| Name |
L-Leucine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, octyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
439.366159058 u |
| Formula |
C26H49NO4 |
| InChI |
InChI=1S/C26H49NO4/c1-8-9-10-11-12-13-16-30-25(28)23(17-19(2)3)27(7)26(29)31-24-18-21(6)14-15-22(24)20(4)5/h19-24H,8-18H2,1-7H3 |
| InChIKey |
JKVPJVACKJOOQO-UHFFFAOYSA-N |
| Molecular Weight |
439.681 g/mol |
| SMILES |
C(C)(C)CC(N(C)C(=O)OC1C(C(C)C)CCC(C)C1)C(OCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.838981 |
