CID 3023656

N,n-bis(hydroxymethyl)docosanamide

Structural Information

Molecular Formula
C24H49NO3
SMILES
CCCCCCCCCCCCCCCCCCCCCC(=O)N(CO)CO
InChI
InChI=1S/C24H49NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24(28)25(22-26)23-27/h26-27H,2-23H2,1H3
InChIKey
ZTEZOZYPRLUDGM-UHFFFAOYSA-N
Compound name
N,N-bis(hydroxymethyl)docosanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

399.37125 Da
Monoisotopic Mass

9.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.378526 212.7
[M+Na]+ 422.360468 210.8
[M-H]- 398.363974 208.1
[M+NH4]+ 417.405073 220.1
[M+K]+ 438.334408 206.9
[M+H-H2O]+ 382.368510 204.3
[M+HCOO]- 444.369451 227.9
[M+CH3COO]- 458.385101 229.1
[M+Na-2H]- 420.345916 207.5
[M]+ 399.37070142 220.3
[M]- 399.37179858 220.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.