CID 480888

Dodecyl(ethoxymethyl)dimethylamine, chloride

Structural Information

Molecular Formula
C17H38NO
SMILES
CCCCCCCCCCCC[N+](C)(C)COCC
InChI
InChI=1S/C17H38NO/c1-5-7-8-9-10-11-12-13-14-15-16-18(3,4)17-19-6-2/h5-17H2,1-4H3/q+1
InChIKey
IAZCRFCHJZAXEJ-UHFFFAOYSA-N
Compound name
dodecyl-(ethoxymethyl)-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.29535 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.30263 174.3
[M+Na]+ 295.28457 177.1
[M-H]- 271.28807 174.5
[M+NH4]+ 290.32917 191.5
[M+K]+ 311.25851 170.1
[M+H-H2O]+ 255.29261 170.8
[M+HCOO]- 317.29355 195.3
[M+CH3COO]- 331.30920 204.0
[M+Na-2H]- 293.27002 179.3
[M]+ 272.29480 180.2
[M]- 272.29590 180.2
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.