| SpectraBase Spectrum ID |
86tlI6LBjA3 |
| Name |
L-Norvaline, N-((1R)-(-)-menthyloxycarbonyl)-, dodecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
467.397459187 u |
| Formula |
C28H53NO4 |
| InChI |
InChI=1S/C28H53NO4/c1-6-8-9-10-11-12-13-14-15-16-20-32-27(30)25(17-7-2)29-28(31)33-26-21-23(5)18-19-24(26)22(3)4/h22-26H,6-21H2,1-5H3,(H,29,31) |
| InChIKey |
LCIQVNUQTAWYEC-UHFFFAOYSA-N |
| Molecular Weight |
467.735 g/mol |
| SMILES |
CCCC(C(OCCCCCCCCCCCC)=O)NC(=O)OC1C(CCC(C1)C)C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.864937 |
