CID 101104635

4-(dimethylamino)bicyclo[2.2.2]octane-1-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C11H19NO2
SMILES
CN(C)C12CCC(CC1)(CC2)C(=O)O
InChI
InChI=1S/C11H19NO2/c1-12(2)11-6-3-10(4-7-11,5-8-11)9(13)14/h3-8H2,1-2H3,(H,13,14)
InChIKey
BZUQEBLDGGPFQE-UHFFFAOYSA-N
Compound name
4-(dimethylamino)bicyclo[2.2.2]octane-1-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.14159 Da
Monoisotopic Mass

-1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.14887 145.1
[M+Na]+ 220.13081 152.5
[M+NH4]+ 215.17541 157.9
[M+K]+ 236.10475 143.3
[M-H]- 196.13431 143.0
[M+Na-2H]- 218.11626 145.2
[M]+ 197.14104 145.6
[M]- 197.14214 145.6
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.