CID 3025322

Phosphonic acid, (p-methylaminophenyl)-

Structural Information

Molecular Formula

C₇H₁₀NO₃P

SMILES

CNC1=CC=C(C=C1)P(=O)(O)O

InChI

InChI=1S/C7H10NO3P/c1-8-6-2-4-7(5-3-6)12(9,10)11/h2-5,8H,1H3,(H2,9,10,11)

InChIKey

QCYXQNFMQMWMQF-UHFFFAOYSA-N

Compound name

[4-(methylamino)phenyl]phosphonic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 187.03983 Da
Monoisotopic Mass: -0.1
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]+	188.04711	138.7
[M+Na]+	210.02905	148.5
[M+NH4]+	205.07365	145.2
[M+K]+	226.00299	144.9
[M-H]-	186.03255	138.5
[M+Na-2H]-	208.01450	143.6
[M]+	187.03928	139.7
[M]-	187.04038	139.7

Literature stripe

literature stripe

Patent stripe

patents stripe