| SpectraBase Spectrum ID |
HF5ZhdRmcXK |
| Name |
L-Proline, N-valeryl-, dodecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
367.308644181 u |
| Formula |
C22H41NO3 |
| InChI |
InChI=1S/C22H41NO3/c1-3-5-7-8-9-10-11-12-13-14-19-26-22(25)20-16-15-18-23(20)21(24)17-6-4-2/h20H,3-19H2,1-2H3 |
| InChIKey |
XZTTWSXRUPIKBG-UHFFFAOYSA-N |
| Molecular Weight |
367.574 g/mol |
| SMILES |
C(C1CCCN1C(=O)CCCC)(=O)OCCCCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.961105 |
