CID 125425794

7-methoxyquinoline-8-sulfonyl chloride

Structural Information

Molecular Formula
C10H8ClNO3S
SMILES
COC1=C(C2=C(C=CC=N2)C=C1)S(=O)(=O)Cl
InChI
InChI=1S/C10H8ClNO3S/c1-15-8-5-4-7-3-2-6-12-9(7)10(8)16(11,13)14/h2-6H,1H3
InChIKey
BOYGXUWPYKJSSH-UHFFFAOYSA-N
Compound name
7-methoxyquinoline-8-sulfonyl chloride
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

19
Patents

256.99133 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 257.99861 149.0
[M+Na]+ 279.98055 160.8
[M-H]- 255.98405 153.3
[M+NH4]+ 275.02515 167.5
[M+K]+ 295.95449 156.2
[M+H-H2O]+ 239.98859 143.9
[M+HCOO]- 301.98953 161.6
[M+CH3COO]- 316.00518 189.2
[M+Na-2H]- 277.96600 156.1
[M]+ 256.99078 156.0
[M]- 256.99188 156.0
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

patents stripe