CID 498946

Nsc641009

Structural Information

Molecular Formula

C₆H₁₁Cl₃O₂Te

SMILES

CCCCC(C=O)O[Te](Cl)(Cl)Cl

InChI

InChI=1S/C6H11Cl3O2Te/c1-2-3-4-6(5-10)11-12(7,8)9/h5-6H,2-4H2,1H3

InChIKey

IPFARNACCXXLQN-UHFFFAOYSA-N

Compound name

2-(trichloro-lambda4-tellanyl)oxyhexanal

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 349.88867 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]+	350.89595	166.4
[M+Na]+	372.87789	173.8
[M-H]-	348.88139	164.4
[M+NH4]+	367.92249	184.4
[M+K]+	388.85183	168.7
[M+H-H2O]+	332.88593	163.4
[M+HCOO]-	394.88687	171.9
[M+CH3COO]-	408.90252	192.8
[M+Na-2H]-	370.86334	167.9
[M]+	349.88812	171.5
[M]-	349.88922	171.5

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.