CID 3468488

144009-06-3

Structural Information

Molecular Formula
C22H46NO3
SMILES
CCCCCCCCCCCCCC[N+](C)(C)CCOCCOC(=O)C
InChI
InChI=1S/C22H46NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-23(3,4)18-19-25-20-21-26-22(2)24/h5-21H2,1-4H3/q+1
InChIKey
GKBYSUFSEBBYKW-UHFFFAOYSA-N
Compound name
2-(2-acetyloxyethoxy)ethyl-dimethyl-tetradecylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

372.34778 Da
Monoisotopic Mass

6.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 373.35506 198.4
[M+Na]+ 395.33700 206.3
[M+NH4]+ 390.38160 204.1
[M+K]+ 411.31094 199.5
[M-H]- 371.34050 198.5
[M+Na-2H]- 393.32245 199.1
[M]+ 372.34723 199.7
[M]- 372.34833 199.7
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.