SpectraBase Spectrum ID |
8J5gH3kUH6h |
Name |
D-Proline, N-methoxycarbonyl-, undecyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
327.240958543 u |
Formula |
C18H33NO4 |
InChI |
InChI=1S/C18H33NO4/c1-3-4-5-6-7-8-9-10-11-15-23-17(20)16-13-12-14-19(16)18(21)22-2/h16H,3-15H2,1-2H3 |
InChIKey |
NWOIUIKGJANZTI-UHFFFAOYSA-N |
Molecular Weight |
327.465 g/mol |
SMILES |
CCCCCCCCCCCOC(C1N(CCC1)C(OC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.81394 |