CID 76277

Dimethyl phenylphosphonite

Structural Information

Molecular Formula

C₈H₁₁O₂P

SMILES

COP(C1=CC=CC=C1)OC

InChI

InChI=1S/C8H11O2P/c1-9-11(10-2)8-6-4-3-5-7-8/h3-7H,1-2H3

InChIKey

LMZLQYYLELWCCW-UHFFFAOYSA-N

Compound name

dimethoxy(phenyl)phosphane

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 1
References: 1126
Patents: 170.04967 Da
Monoisotopic Mass: 1.6
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]+	171.056946	137.0
[M+Na]+	193.038888	144.0
[M-H]-	169.042394	139.4
[M+NH4]+	188.083493	157.9
[M+K]+	209.012828	143.7
[M+H-H2O]+	153.046930	128.9
[M+HCOO]-	215.047871	166.4
[M+CH3COO]-	229.063521	180.2
[M+Na-2H]-	191.024336	140.3
[M]+	170.04912142	140.3
[M]-	170.05021858	140.3

Literature stripe

literature stripe

Patent stripe

patents stripe