CID 822465

6-chloro-n-(furan-2-ylmethyl)pyridine-3-sulfonamide

Structural Information

Molecular Formula
C10H9ClN2O3S
SMILES
C1=COC(=C1)CNS(=O)(=O)C2=CN=C(C=C2)Cl
InChI
InChI=1S/C10H9ClN2O3S/c11-10-4-3-9(7-12-10)17(14,15)13-6-8-2-1-5-16-8/h1-5,7,13H,6H2
InChIKey
DDCCIGORNPGVJG-UHFFFAOYSA-N
Compound name
6-chloro-N-(furan-2-ylmethyl)pyridine-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

272.00223 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.00951 156.4
[M+Na]+ 294.99145 166.6
[M-H]- 270.99495 163.5
[M+NH4]+ 290.03605 173.0
[M+K]+ 310.96539 162.9
[M+H-H2O]+ 254.99949 150.4
[M+HCOO]- 317.00043 171.6
[M+CH3COO]- 331.01608 191.1
[M+Na-2H]- 292.97690 161.7
[M]+ 272.00168 162.1
[M]- 272.00278 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

literature stripe

Patent stripe

No patent data available for this compound.