CID 85210

15961-23-6

Structural Information

Molecular Formula

C₃H₅Cl₃GeO₂

SMILES

C(C[Ge](Cl)(Cl)Cl)C(=O)O

InChI

InChI=1S/C3H5Cl3GeO2/c4-7(5,6)2-1-3(8)9/h1-2H2,(H,8,9)

InChIKey

NLIJOIUVZBYQRS-UHFFFAOYSA-N

Compound name

3-trichlorogermylpropanoic acid

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 112
Patents: 251.85669 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]+	252.86397	141.6
[M+Na]+	274.84591	150.3
[M-H]-	250.84941	139.2
[M+NH4]+	269.89051	161.1
[M+K]+	290.81985	145.4
[M+H-H2O]+	234.85395	140.2
[M+HCOO]-	296.85489	147.3
[M+CH3COO]-	310.87054	179.4
[M+Na-2H]-	272.83136	145.5
[M]+	251.85614	143.7
[M]-	251.85724	143.7

Literature stripe

literature stripe

Patent stripe

patents stripe