CID 43135693

1-(cyclopentylcarbamoyl)piperidine-3-carboxylic acid

Structural Information

Molecular Formula
C12H20N2O3
SMILES
C1CCC(C1)NC(=O)N2CCCC(C2)C(=O)O
InChI
InChI=1S/C12H20N2O3/c15-11(16)9-4-3-7-14(8-9)12(17)13-10-5-1-2-6-10/h9-10H,1-8H2,(H,13,17)(H,15,16)
InChIKey
GUJQGXPEJFDCGP-UHFFFAOYSA-N
Compound name
1-(cyclopentylcarbamoyl)piperidine-3-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

240.1474 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 241.15468 156.9
[M+Na]+ 263.13662 158.6
[M-H]- 239.14012 159.3
[M+NH4]+ 258.18122 173.0
[M+K]+ 279.11056 156.9
[M+H-H2O]+ 223.14466 149.4
[M+HCOO]- 285.14560 172.6
[M+CH3COO]- 299.16125 188.9
[M+Na-2H]- 261.12207 155.5
[M]+ 240.14685 148.6
[M]- 240.14795 148.6
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

No patent data available for this compound.