CID 511845

Benzoyl chloride, 2-(chloroseleno)-

Structural Information

Molecular Formula

C₇H₄Cl₂OSe

SMILES

C1=CC=C(C(=C1)C(=O)Cl)[Se]Cl

InChI

InChI=1S/C7H4Cl2OSe/c8-7(10)5-3-1-2-4-6(5)11-9/h1-4H

InChIKey

DRUYRXYUOIXCBT-UHFFFAOYSA-N

Compound name

(2-carbonochloridoylphenyl) selenohypochlorite

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 72
Patents: 253.88045 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]+	254.88773	144.2
[M+Na]+	276.86967	153.7
[M-H]-	252.87317	146.9
[M+NH4]+	271.91427	164.6
[M+K]+	292.84361	148.5
[M+H-H2O]+	236.87771	140.0
[M+HCOO]-	298.87865	158.2
[M+CH3COO]-	312.89430	182.4
[M+Na-2H]-	274.85512	148.7
[M]+	253.87990	147.3
[M]-	253.88100	147.3

Literature stripe

literature stripe

Patent stripe

patents stripe