CID 174404

84962-98-1

Structural Information

Molecular Formula

C₄H₁₃O₆PSi

SMILES

CP(=O)(O)OCCC[Si](O)(O)O

InChI

InChI=1S/C4H13O6PSi/c1-11(5,6)10-3-2-4-12(7,8)9/h7-9H,2-4H2,1H3,(H,5,6)

InChIKey

HDUNVICUTAZXTE-UHFFFAOYSA-N

Compound name

methyl(3-trihydroxysilylpropoxy)phosphinic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 769
Patents: 216.0219 Da
Monoisotopic Mass: None
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]+	217.02918	143.1
[M+Na]+	239.01112	148.3
[M+NH4]+	234.05572	146.4
[M+K]+	254.98506	148.5
[M-H]-	215.01462	136.4
[M+Na-2H]-	236.99657	141.8
[M]+	216.02135	141.3
[M]-	216.02245	141.3

Literature stripe

literature stripe

Patent stripe

patents stripe