CID 146155819

2416234-33-6

Structural Information

Molecular Formula
C9H16N2O2
SMILES
C1CN(CCC1C(=O)O)C2CNC2
InChI
InChI=1S/C9H16N2O2/c12-9(13)7-1-3-11(4-2-7)8-5-10-6-8/h7-8,10H,1-6H2,(H,12,13)
InChIKey
WCRRIIGHCBVLDO-UHFFFAOYSA-N
Compound name
1-(azetidin-3-yl)piperidine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

184.12119 Da
Monoisotopic Mass

-2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 185.128466 141.5
[M+Na]+ 207.110408 144.0
[M-H]- 183.113914 141.4
[M+NH4]+ 202.155013 150.2
[M+K]+ 223.084348 144.9
[M+H-H2O]+ 167.118450 128.7
[M+HCOO]- 229.119391 154.0
[M+CH3COO]- 243.135041 179.6
[M+Na-2H]- 205.095856 143.3
[M]+ 184.12064142 142.1
[M]- 184.12173858 142.1
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.