| SpectraBase Spectrum ID |
Eg0lW1dkZuk |
| Name |
dl-Valine, N-methyl-N-(vinyloxycarbonyl)-, tridecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
383.303558800 u |
| Formula |
C22H41NO4 |
| InChI |
InChI=1S/C22H41NO4/c1-6-8-9-10-11-12-13-14-15-16-17-18-27-21(24)20(19(3)4)23(5)22(25)26-7-2/h7,19-20H,2,6,8-18H2,1,3-5H3 |
| InChIKey |
OQXBGIHHESCAIN-UHFFFAOYSA-N |
| Molecular Weight |
383.573 g/mol |
| SMILES |
C(C(C(OCCCCCCCCCCCCC)=O)N(C)C(=O)OC=C)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.830336 |
