SpectraBase Spectrum ID |
85SD6H9xmvL |
Name |
N,N'-Diheptyl-2,N,N'-trimethylmalonamide |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
340.308978534 u |
Formula |
C20H40N2O2 |
InChI |
InChI=1S/C20H40N2O2/c1-6-8-10-12-14-16-21(4)19(23)18(3)20(24)22(5)17-15-13-11-9-7-2/h18H,6-17H2,1-5H3 |
InChIKey |
JAHOBRXJYOIHEU-UHFFFAOYSA-N |
Molecular Weight |
340.552 g/mol |
SMILES |
CN(CCCCCCC)C(C(C)C(N(C)CCCCCCC)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.979074 |