CID 4777956

1-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid

Structural Information

Molecular Formula
C10H15NO3
SMILES
C1CCC(C1)N2CC(CC2=O)C(=O)O
InChI
InChI=1S/C10H15NO3/c12-9-5-7(10(13)14)6-11(9)8-3-1-2-4-8/h7-8H,1-6H2,(H,13,14)
InChIKey
DZQZKPNTCXAUKJ-UHFFFAOYSA-N
Compound name
1-cyclopentyl-5-oxopyrrolidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

4
References

0
Patents

197.1052 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.112476 145.0
[M+Na]+ 220.094418 150.4
[M-H]- 196.097924 148.6
[M+NH4]+ 215.139023 165.3
[M+K]+ 236.068358 148.8
[M+H-H2O]+ 180.102460 139.0
[M+HCOO]- 242.103401 163.5
[M+CH3COO]- 256.119051 179.4
[M+Na-2H]- 218.079866 143.3
[M]+ 197.10465142 140.1
[M]- 197.10574858 140.1
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

No patent data available for this compound.