CID 50990651

2-hydroxycyclohexane-1-sulfonyl chloride

Structural Information

Molecular Formula

C₆H₁₁ClO₃S

SMILES

C1CCC(C(C1)O)S(=O)(=O)Cl

InChI

InChI=1S/C6H11ClO3S/c7-11(9,10)6-4-2-1-3-5(6)8/h5-6,8H,1-4H2

InChIKey

HPXWZMBYQSLXBP-UHFFFAOYSA-N

Compound name

2-hydroxycyclohexane-1-sulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 25
Patents: 198.01175 Da
Monoisotopic Mass: 1.6
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]+	199.01903	138.0
[M+Na]+	221.00097	148.1
[M+NH4]+	216.04557	146.2
[M+K]+	236.97491	141.5
[M-H]-	197.00447	138.0
[M+Na-2H]-	218.98642	141.5
[M]+	198.01120	140.0
[M]-	198.01230	140.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe