| SpectraBase Spectrum ID |
5V3AJikqbNj |
| Name |
Sarcosine, N-valeryl-, heptadecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
411.371244439 u |
| Formula |
C25H49NO3 |
| InChI |
InChI=1S/C25H49NO3/c1-4-6-8-9-10-11-12-13-14-15-16-17-18-19-20-22-29-25(28)23-26(3)24(27)21-7-5-2/h4-23H2,1-3H3 |
| InChIKey |
RKAAXXKJRLMTRO-UHFFFAOYSA-N |
| Molecular Weight |
411.671 g/mol |
| SMILES |
C(CCCCCCOC(CN(C(=O)CCCC)C)=O)CCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940137 |
