CID 200911

2933-16-6

Structural Information

Molecular Formula
C20H41N2
SMILES
CC[N+](CC)(CC)CCN(C1CCCCC1)C2CCCCC2
InChI
InChI=1S/C20H41N2/c1-4-22(5-2,6-3)18-17-21(19-13-9-7-10-14-19)20-15-11-8-12-16-20/h19-20H,4-18H2,1-3H3/q+1
InChIKey
BGGAEDJCRWADBA-UHFFFAOYSA-N
Compound name
2-(dicyclohexylamino)ethyl-triethylazanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

309.32697 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 310.33425 180.5
[M+Na]+ 332.31619 177.3
[M-H]- 308.31969 186.3
[M+NH4]+ 327.36079 194.9
[M+K]+ 348.29013 170.2
[M+H-H2O]+ 292.32423 174.3
[M+HCOO]- 354.32517 196.0
[M+CH3COO]- 368.34082 211.9
[M+Na-2H]- 330.30164 182.7
[M]+ 309.32642 172.5
[M]- 309.32752 172.5
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.