CID 10821958

(piperidin-4-yl)phosphonic acid hydrochloride

Structural Information

Molecular Formula
C5H12NO3P
SMILES
C1CNCCC1P(=O)(O)O
InChI
InChI=1S/C5H12NO3P/c7-10(8,9)5-1-3-6-4-2-5/h5-6H,1-4H2,(H2,7,8,9)
InChIKey
SIUHDQKKTWZIQP-UHFFFAOYSA-N
Compound name
piperidin-4-ylphosphonic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

10
Patents

165.05548 Da
Monoisotopic Mass

-3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 166.06276 137.6
[M+Na]+ 188.04470 142.1
[M-H]- 164.04820 133.7
[M+NH4]+ 183.08930 154.8
[M+K]+ 204.01864 140.3
[M+H-H2O]+ 148.05274 130.1
[M+HCOO]- 210.05368 157.5
[M+CH3COO]- 224.06933 167.8
[M+Na-2H]- 186.03015 140.1
[M]+ 165.05493 131.0
[M]- 165.05603 131.0
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

patents stripe