SpectraBase Spectrum ID |
RIJT79fibb |
Name |
Acetamide, 2,2'-[(2,2-dimethyl-1,3-propanediyl)bis(oxy)]bis[N,N-dicyclohexyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
546.439658352 u |
Formula |
C33H58N2O4 |
InChI |
InChI=1S/C33H58N2O4/c1-33(2,25-38-23-31(36)34(27-15-7-3-8-16-27)28-17-9-4-10-18-28)26-39-24-32(37)35(29-19-11-5-12-20-29)30-21-13-6-14-22-30/h27-30H,3-26H2,1-2H3 |
InChIKey |
KMMORZBXZZSBBD-UHFFFAOYSA-N |
Molecular Weight |
546.837 g/mol |
SMILES |
C1CCCC(C1)N(C1CCCCC1)C(=O)COCC(C)(COCC(N(C1CCCCC1)C1CCCCC1)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.822039 |