CID 45791792

2-chloro-6-methoxyquinoline-7-sulfonyl chloride

Structural Information

Molecular Formula
C10H7Cl2NO3S
SMILES
COC1=C(C=C2C(=C1)C=CC(=N2)Cl)S(=O)(=O)Cl
InChI
InChI=1S/C10H7Cl2NO3S/c1-16-8-4-6-2-3-10(11)13-7(6)5-9(8)17(12,14)15/h2-5H,1H3
InChIKey
UIIVYMOPZHLHJH-UHFFFAOYSA-N
Compound name
2-chloro-6-methoxyquinoline-7-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

290.95236 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 291.95964 153.8
[M+Na]+ 313.94158 166.4
[M-H]- 289.94508 157.9
[M+NH4]+ 308.98618 171.6
[M+K]+ 329.91552 161.0
[M+H-H2O]+ 273.94962 149.6
[M+HCOO]- 335.95056 161.3
[M+CH3COO]- 349.96621 194.9
[M+Na-2H]- 311.92703 159.5
[M]+ 290.95181 162.1
[M]- 290.95291 162.1
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.