| SpectraBase Spectrum ID |
F5tY7xyQBRv |
| Name |
L-Proline, N-valeryl-, nonyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
325.261693988 u |
| Formula |
C19H35NO3 |
| InChI |
InChI=1S/C19H35NO3/c1-3-5-7-8-9-10-11-16-23-19(22)17-13-12-15-20(17)18(21)14-6-4-2/h17H,3-16H2,1-2H3 |
| InChIKey |
WFZGINJFRBBQIA-UHFFFAOYSA-N |
| Molecular Weight |
325.493 g/mol |
| SMILES |
C(C1CCCN1C(=O)CCCC)(=O)OCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92422 |
