CID 20562867

N-butyl-n,n-dimethyloctadecan-1-aminium chloride

Structural Information

Molecular Formula
C24H52N
SMILES
CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCC
InChI
InChI=1S/C24H52N/c1-5-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-25(3,4)23-8-6-2/h5-24H2,1-4H3/q+1
InChIKey
FJWLQVVPVGCXPV-UHFFFAOYSA-N
Compound name
butyl-dimethyl-octadecylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

354.40997 Da
Monoisotopic Mass

10.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 355.41725 199.8
[M+Na]+ 377.39919 209.1
[M+NH4]+ 372.44379 207.3
[M+K]+ 393.37313 199.4
[M-H]- 353.40269 201.9
[M+Na-2H]- 375.38464 201.8
[M]+ 354.40942 202.1
[M]- 354.41052 202.1
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

patents stripe