CID 3075485

183999-59-9

Structural Information

Molecular Formula
C13H8N4O4S2
SMILES
C1=CC=C2C(=C1)C=C(C(=O)O2)C3=CN4C(=N3)SC(=N4)S(=O)(=O)N
InChI
InChI=1S/C13H8N4O4S2/c14-23(19,20)13-16-17-6-9(15-12(17)22-13)8-5-7-3-1-2-4-10(7)21-11(8)18/h1-6H,(H2,14,19,20)
InChIKey
SXWVOIKIEIZZDG-UHFFFAOYSA-N
Compound name
6-(2-oxochromen-3-yl)imidazo[2,1-b][1,3,4]thiadiazole-2-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

347.9987 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 349.00598 174.4
[M+Na]+ 370.98792 188.5
[M+NH4]+ 366.03252 181.2
[M+K]+ 386.96186 183.4
[M-H]- 346.99142 177.9
[M+Na-2H]- 368.97337 179.8
[M]+ 347.99815 178.3
[M]- 347.99925 178.3
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

patents stripe