| SpectraBase Spectrum ID |
AavNWj3KjnA |
| Name |
L-Leucine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, tridecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
509.444409380 u |
| Formula |
C31H59NO4 |
| InChI |
InChI=1S/C31H59NO4/c1-8-9-10-11-12-13-14-15-16-17-18-21-35-30(33)28(22-24(2)3)32(7)31(34)36-29-23-26(6)19-20-27(29)25(4)5/h24-29H,8-23H2,1-7H3 |
| InChIKey |
IEACPNHLZRUODK-UHFFFAOYSA-N |
| Molecular Weight |
509.816 g/mol |
| SMILES |
C(C)(C)CC(N(C)C(=O)OC1C(C(C)C)CCC(C)C1)C(OCCCCCCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.911163 |
