CID 139595217

Dichlorofluoromethane-sulfenic-acid

Structural Information

Molecular Formula

SMILES

C(F)(SO)(Cl)Cl

InChI

InChI=1S/CHCl2FOS/c2-1(3,4)6-5/h5H

InChIKey

HFMYRCYWBSNXAI-UHFFFAOYSA-N

Compound name

dichloro-fluoro-hydroxysulfanylmethane

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 0
References: 1
Patents: 149.91092 Da
Monoisotopic Mass: 1.7
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]+	150.91820	117.6
[M+Na]+	172.90014	127.6
[M-H]-	148.90364	115.9
[M+NH4]+	167.94474	139.9
[M+K]+	188.87408	123.6
[M+H-H2O]+	132.90818	115.5
[M+HCOO]-	194.90912	124.3
[M+CH3COO]-	208.92477	167.4
[M+Na-2H]-	170.88559	122.2
[M]+	149.91037	119.2
[M]-	149.91147	119.2

Literature stripe

literature stripe

Patent stripe

patents stripe