CID 83309

Triethylhexadecylammonium chloride

Structural Information

Molecular Formula
C22H48N
SMILES
CCCCCCCCCCCCCCCC[N+](CC)(CC)CC
InChI
InChI=1S/C22H48N/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(6-2,7-3)8-4/h5-22H2,1-4H3/q+1
InChIKey
ADBMSVFHVFJBFR-UHFFFAOYSA-N
Compound name
triethyl(hexadecyl)azanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

15
References

4334
Patents

326.37866 Da
Monoisotopic Mass

9.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.38594 191.0
[M+Na]+ 349.36788 200.7
[M+NH4]+ 344.41248 198.8
[M+K]+ 365.34182 191.5
[M-H]- 325.37138 193.2
[M+Na-2H]- 347.35333 193.5
[M]+ 326.37811 193.4
[M]- 326.37921 193.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe