CID 498849

Nsc635810

Structural Information

Molecular Formula

C₄H₇Cl₃O₂Te

SMILES

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

InChI

InChI=1S/C4H7Cl3O2Te/c1-2-4(3-8)9-10(5,6)7/h3-4H,2H2,1H3

InChIKey

MCEMSTTWALWNHV-UHFFFAOYSA-N

Compound name

2-(trichloro-lambda4-tellanyl)oxybutanal

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 321.8574 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]+	322.864676	157.2
[M+Na]+	344.846618	165.4
[M-H]-	320.850124	155.5
[M+NH4]+	339.891223	176.2
[M+K]+	360.820558	160.8
[M+H-H2O]+	304.854660	154.6
[M+HCOO]-	366.855601	163.3
[M+CH3COO]-	380.871251	187.1
[M+Na-2H]-	342.832066	159.8
[M]+	321.85685142	161.6
[M]-	321.85794858	161.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.