CID 3607463

13018-95-6

Structural Information

Molecular Formula
C22H48NO
SMILES
CCCCCCCCCCCCCCCCCC[N+](C)(C)CCO
InChI
InChI=1S/C22H48NO/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-23(2,3)21-22-24/h24H,4-22H2,1-3H3/q+1
InChIKey
KDOKFXJQGPCGLT-UHFFFAOYSA-N
Compound name
2-hydroxyethyl-dimethyl-octadecylazanium
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

743
Patents

342.3736 Da
Monoisotopic Mass

8.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 343.38088 197.1
[M+Na]+ 365.36282 197.3
[M-H]- 341.36632 194.9
[M+NH4]+ 360.40742 210.7
[M+K]+ 381.33676 188.0
[M+H-H2O]+ 325.37086 192.8
[M+HCOO]- 387.37180 214.9
[M+CH3COO]- 401.38745 216.1
[M+Na-2H]- 363.34827 199.0
[M]+ 342.37305 202.9
[M]- 342.37415 202.9
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