| SpectraBase Spectrum ID |
JfcfLp7TDEp |
| Name |
dl-Alanine, N-methyl-N-(2-ethylhexyloxycarbonyl)-, heptadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
497.444409380 u |
| Formula |
C30H59NO4 |
| InChI |
InChI=1S/C30H59NO4/c1-6-9-11-12-13-14-15-16-17-18-19-20-21-22-23-25-34-29(32)27(4)31(5)30(33)35-26-28(8-3)24-10-7-2/h27-28H,6-26H2,1-5H3 |
| InChIKey |
UFZSAZSEOIWYRI-UHFFFAOYSA-N |
| Molecular Weight |
497.805 g/mol |
| SMILES |
CC(N(C)C(=O)OCC(CCCC)CC)C(=O)OCCCCCCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.956471 |
