SpectraBase Spectrum ID |
4r87wooD3mH |
Name |
Cyclohexanecarboxamide, N-propyl-N-dodecyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
337.334465008 u |
Formula |
C22H43NO |
InChI |
InChI=1S/C22H43NO/c1-3-5-6-7-8-9-10-11-12-16-20-23(19-4-2)22(24)21-17-14-13-15-18-21/h21H,3-20H2,1-2H3 |
InChIKey |
UQEBRQHYCYGIHO-UHFFFAOYSA-N |
Molecular Weight |
337.592 g/mol |
SMILES |
C(=O)(N(CCC)CCCCCCCCCCCC)C1CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.9274 |