CID 3065790

Phosphinic acid, (m-aminophenyl)phenyl-

Structural Information

Molecular Formula

C₁₂H₁₂NO₂P

SMILES

C1=CC=C(C=C1)P(=O)(C2=CC=CC(=C2)N)O

InChI

InChI=1S/C12H12NO2P/c13-10-5-4-8-12(9-10)16(14,15)11-6-2-1-3-7-11/h1-9H,13H2,(H,14,15)

InChIKey

RXPMDUZWXQWWHC-UHFFFAOYSA-N

Compound name

(3-aminophenyl)-phenylphosphinic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 233.06056 Da
Monoisotopic Mass: 1.3
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]+	234.06784	151.8
[M+Na]+	256.04978	164.4
[M+NH4]+	251.09438	159.6
[M+K]+	272.02372	158.4
[M-H]-	232.05328	155.3
[M+Na-2H]-	254.03523	160.3
[M]+	233.06001	154.5
[M]-	233.06111	154.5

Literature stripe

literature stripe

Patent stripe

patents stripe