CID 14271496

6-methylnaphthalene-2-sulfonyl chloride

Structural Information

Molecular Formula

C₁₁H₉ClO₂S

SMILES

CC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)Cl

InChI

InChI=1S/C11H9ClO2S/c1-8-2-3-10-7-11(15(12,13)14)5-4-9(10)6-8/h2-7H,1H3

InChIKey

OXHYCRDRXFZPMW-UHFFFAOYSA-N

Compound name

6-methylnaphthalene-2-sulfonyl chloride

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 12
Patents: 240.00117 Da
Monoisotopic Mass: 3.6
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]+	241.00845	148.1
[M+Na]+	262.99039	163.5
[M+NH4]+	258.03499	158.0
[M+K]+	278.96433	153.8
[M-H]-	238.99389	150.9
[M+Na-2H]-	260.97584	155.6
[M]+	240.00062	152.1
[M]-	240.00172	152.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe