CID 18670

3282-73-3

Structural Information

Molecular Formula
C26H56N
SMILES
CCCCCCCCCCCC[N+](C)(C)CCCCCCCCCCCC
InChI
InChI=1S/C26H56N/c1-5-7-9-11-13-15-17-19-21-23-25-27(3,4)26-24-22-20-18-16-14-12-10-8-6-2/h5-26H2,1-4H3/q+1
InChIKey
QQJDHWMADUVRDL-UHFFFAOYSA-N
Compound name
didodecyl(dimethyl)azanium
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

307
References

21302
Patents

382.44128 Da
Monoisotopic Mass

11.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 383.44856 211.8
[M+Na]+ 405.43050 210.8
[M-H]- 381.43400 210.2
[M+NH4]+ 400.47510 231.5
[M+K]+ 421.40444 201.0
[M+H-H2O]+ 365.43854 206.6
[M+HCOO]- 427.43948 250.0
[M+CH3COO]- 441.45513 229.1
[M+Na-2H]- 403.41595 211.9
[M]+ 382.44073 219.6
[M]- 382.44183 219.6
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