CID 63938441

Rac-(3r,4r)-4-(2,2-dimethylpropyl)pyrrolidine-3-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C10H19NO2
SMILES
CC(C)(C)CC1CNCC1C(=O)O
InChI
InChI=1S/C10H19NO2/c1-10(2,3)4-7-5-11-6-8(7)9(12)13/h7-8,11H,4-6H2,1-3H3,(H,12,13)
InChIKey
XAYWRGAYKROIFI-UHFFFAOYSA-N
Compound name
4-(2,2-dimethylpropyl)pyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

185.14159 Da
Monoisotopic Mass

-0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.14887 145.6
[M+Na]+ 208.13081 150.9
[M-H]- 184.13431 144.6
[M+NH4]+ 203.17541 164.6
[M+K]+ 224.10475 148.9
[M+H-H2O]+ 168.13885 140.5
[M+HCOO]- 230.13979 161.3
[M+CH3COO]- 244.15544 177.3
[M+Na-2H]- 206.11626 146.8
[M]+ 185.14104 141.7
[M]- 185.14214 141.7
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.