CID 203969

Of 1701

Structural Information

Molecular Formula
C15H32N2O2
SMILES
CC1CCCC([N+]1(C)C)C(=O)OCC(C)[N+](C)(C)C
InChI
InChI=1S/C15H32N2O2/c1-12-9-8-10-14(17(12,6)7)15(18)19-11-13(2)16(3,4)5/h12-14H,8-11H2,1-7H3/q+2
InChIKey
XVKAPAIKOZWKCU-UHFFFAOYSA-N
Compound name
trimethyl-[1-(1,1,6-trimethylpiperidin-1-ium-2-carbonyl)oxypropan-2-yl]azanium
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

272.24637 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.253646 160.4
[M+Na]+ 295.235588 164.6
[M-H]- 271.239094 163.7
[M+NH4]+ 290.280193 177.9
[M+K]+ 311.209528 153.7
[M+H-H2O]+ 255.243630 160.6
[M+HCOO]- 317.244571 176.0
[M+CH3COO]- 331.260221 193.8
[M+Na-2H]- 293.221036 167.2
[M]+ 272.24582142 157.7
[M]- 272.24691858 157.7
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.