CID 14457730

3-chloronaphthalene-2-sulfonyl chloride

Structural Information

Molecular Formula
C10H6Cl2O2S
SMILES
C1=CC=C2C=C(C(=CC2=C1)S(=O)(=O)Cl)Cl
InChI
InChI=1S/C10H6Cl2O2S/c11-9-5-7-3-1-2-4-8(7)6-10(9)15(12,13)14/h1-6H
InChIKey
SUPPBFXAIUSRDU-UHFFFAOYSA-N
Compound name
3-chloronaphthalene-2-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.94656 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.95384 147.1
[M+Na]+ 282.93578 159.3
[M-H]- 258.93928 152.3
[M+NH4]+ 277.98038 167.3
[M+K]+ 298.90972 153.2
[M+H-H2O]+ 242.94382 143.9
[M+HCOO]- 304.94476 155.8
[M+CH3COO]- 318.96041 189.1
[M+Na-2H]- 280.92123 153.3
[M]+ 259.94601 153.3
[M]- 259.94711 153.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.