CID 83479184

5,5-dimethylpyrrolidine-3-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C7H13NO2
SMILES
CC1(CC(CN1)C(=O)O)C
InChI
InChI=1S/C7H13NO2/c1-7(2)3-5(4-8-7)6(9)10/h5,8H,3-4H2,1-2H3,(H,9,10)
InChIKey
LTVCDYJGFRJIDI-UHFFFAOYSA-N
Compound name
5,5-dimethylpyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

143.09464 Da
Monoisotopic Mass

-2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.101916 130.9
[M+Na]+ 166.083858 138.0
[M-H]- 142.087364 130.5
[M+NH4]+ 161.128463 153.4
[M+K]+ 182.057798 136.4
[M+H-H2O]+ 126.091900 126.6
[M+HCOO]- 188.092841 149.2
[M+CH3COO]- 202.108491 168.2
[M+Na-2H]- 164.069306 134.1
[M]+ 143.09409142 126.8
[M]- 143.09518858 126.8
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

patents stripe