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]+ 241.154676 156.9
[M+Na]+ 263.136618 158.6
[M-H]- 239.140124 159.3
[M+NH4]+ 258.181223 173.0
[M+K]+ 279.110558 156.9
[M+H-H2O]+ 223.144660 149.4
[M+HCOO]- 285.145601 172.6
[M+CH3COO]- 299.161251 188.9
[M+Na-2H]- 261.122066 155.5
[M]+ 240.14685142 148.6
[M]- 240.14794858 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.