CID 65969857

1487725-55-2

Structural Information

Molecular Formula
C11H10ClNO2S
SMILES
CC1=CC(=C2C=CC=NC2=C1C)S(=O)(=O)Cl
InChI
InChI=1S/C11H10ClNO2S/c1-7-6-10(16(12,14)15)9-4-3-5-13-11(9)8(7)2/h3-6H,1-2H3
InChIKey
KNHPBZRFXARWDQ-UHFFFAOYSA-N
Compound name
7,8-dimethylquinoline-5-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

255.01208 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 256.01936 150.0
[M+Na]+ 278.00130 162.4
[M-H]- 254.00480 154.5
[M+NH4]+ 273.04590 169.0
[M+K]+ 293.97524 157.0
[M+H-H2O]+ 238.00934 145.1
[M+HCOO]- 300.01028 162.0
[M+CH3COO]- 314.02593 191.3
[M+Na-2H]- 275.98675 155.7
[M]+ 255.01153 156.3
[M]- 255.01263 156.3
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.