SpectraBase Spectrum ID |
1MCcngyse1z |
Name |
Oxalic acid, monoamide, N,N-dibutyl, tridecyl ester |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
383.339944310 u |
Formula |
C23H45NO3 |
InChI |
InChI=1S/C23H45NO3/c1-4-7-10-11-12-13-14-15-16-17-18-21-27-23(26)22(25)24(19-8-5-2)20-9-6-3/h4-21H2,1-3H3 |
InChIKey |
HBKFJLYZUZGSLL-UHFFFAOYSA-N |
Molecular Weight |
383.617 g/mol |
SMILES |
CCCCN(C(C(OCCCCCCCCCCCCC)=O)=O)CCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.909363 |