CID 41100

54472-70-7

Structural Information

Molecular Formula
C16H35N2O2
SMILES
CCCCCCCCCCC(C[N+](C)(C)NC(=O)C)O
InChI
InChI=1S/C16H34N2O2/c1-5-6-7-8-9-10-11-12-13-16(20)14-18(3,4)17-15(2)19/h16,20H,5-14H2,1-4H3/p+1
InChIKey
HKSNLMDGZLTQHA-UHFFFAOYSA-O
Compound name
acetamido-(2-hydroxydodecyl)-dimethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

287.26987 Da
Monoisotopic Mass

4.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.27715 173.2
[M+Na]+ 310.25909 180.7
[M+NH4]+ 305.30369 179.5
[M+K]+ 326.23303 176.3
[M-H]- 286.26259 173.5
[M+Na-2H]- 308.24454 174.6
[M]+ 287.26932 174.3
[M]- 287.27042 174.3
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