CID 11528359

3-[(2r)-pyrrolidin-2-yl]propanoic acid hydrochloride

Structural Information

Molecular Formula
C7H13NO2
SMILES
C1C[C@@H](NC1)CCC(=O)O
InChI
InChI=1S/C7H13NO2/c9-7(10)4-3-6-2-1-5-8-6/h6,8H,1-5H2,(H,9,10)/t6-/m1/s1
InChIKey
HIDODKLFTVMWQL-ZCFIWIBFSA-N
Compound name
3-[(2R)-pyrrolidin-2-yl]propanoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

32
Patents

143.09464 Da
Monoisotopic Mass

-2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.101916 132.6
[M+Na]+ 166.083858 137.7
[M-H]- 142.087364 131.3
[M+NH4]+ 161.128463 152.7
[M+K]+ 182.057798 136.0
[M+H-H2O]+ 126.091900 126.8
[M+HCOO]- 188.092841 150.8
[M+CH3COO]- 202.108491 167.5
[M+Na-2H]- 164.069306 135.1
[M]+ 143.09409142 127.7
[M]- 143.09518858 127.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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