CID 2734887

66254-56-6

Structural Information

Molecular Formula

C₄H₁₂NO₃P

SMILES

CC(C)[C@H](N)P(=O)(O)O

InChI

InChI=1S/C4H12NO3P/c1-3(2)4(5)9(6,7)8/h3-4H,5H2,1-2H3,(H2,6,7,8)/t4-/m1/s1

InChIKey

DGSLPJDIFKVSIB-SCSAIBSYSA-N

Compound name

[(1R)-1-amino-2-methylpropyl]phosphonic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 32
Patents: 153.05548 Da
Monoisotopic Mass: -3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	154.06276	133.4
[M+Na]+	176.04470	139.4
[M+NH4]+	171.08930	138.6
[M+K]+	192.01864	138.5
[M-H]-	152.04820	129.6
[M+Na-2H]-	174.03015	133.5
[M]+	153.05493	132.5
[M]-	153.05603	132.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe