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]+ 273.25365 160.4
[M+Na]+ 295.23559 164.6
[M-H]- 271.23909 163.7
[M+NH4]+ 290.28019 177.9
[M+K]+ 311.20953 153.7
[M+H-H2O]+ 255.24363 160.6
[M+HCOO]- 317.24457 176.0
[M+CH3COO]- 331.26022 193.8
[M+Na-2H]- 293.22104 167.2
[M]+ 272.24582 157.7
[M]- 272.24692 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.