| SpectraBase Spectrum ID |
6hBk8HMbHXv |
| Name |
dl-Alanine, N-methyl-N-((1R)-(-)-menthyloxycarbonyl)-, heptadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
523.460059444 u |
| Formula |
C32H61NO4 |
| InChI |
InChI=1S/C32H61NO4/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-36-31(34)28(5)33(6)32(35)37-30-25-27(4)22-23-29(30)26(2)3/h26-30H,7-25H2,1-6H3 |
| InChIKey |
FGHXSSIIXJENQB-UHFFFAOYSA-N |
| Molecular Weight |
523.843 g/mol |
| SMILES |
CC(N(C)C(=O)OC1C(C(C)C)CCC(C)C1)C(=O)OCCCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.89039 |
