CID 21051421

5-ethylpyrrolidine-2-carboxylic acid hydrochloride

Structural Information

Molecular Formula
C7H13NO2
SMILES
CCC1CCC(N1)C(=O)O
InChI
InChI=1S/C7H13NO2/c1-2-5-3-4-6(8-5)7(9)10/h5-6,8H,2-4H2,1H3,(H,9,10)
InChIKey
QUNIAINQNHRELE-UHFFFAOYSA-N
Compound name
5-ethylpyrrolidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

14
Patents

143.09464 Da
Monoisotopic Mass

-1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.10192 132.1
[M+Na]+ 166.08386 138.2
[M-H]- 142.08736 131.2
[M+NH4]+ 161.12846 152.5
[M+K]+ 182.05780 136.4
[M+H-H2O]+ 126.09190 126.6
[M+HCOO]- 188.09284 150.3
[M+CH3COO]- 202.10849 168.6
[M+Na-2H]- 164.06931 134.0
[M]+ 143.09409 127.6
[M]- 143.09519 127.6
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

patents stripe