CID 54690697

4-hydroxy-2-oxo-2h-chromene-3-sulfonamide

Structural Information

Molecular Formula
C9H7NO5S
SMILES
C1=CC=C2C(=C1)C(=C(C(=O)O2)S(=O)(=O)N)O
InChI
InChI=1S/C9H7NO5S/c10-16(13,14)8-7(11)5-3-1-2-4-6(5)15-9(8)12/h1-4,11H,(H2,10,13,14)
InChIKey
WYMXTUAQMCLUOC-UHFFFAOYSA-N
Compound name
4-hydroxy-2-oxochromene-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.00449 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.01177 144.5
[M+Na]+ 263.99371 155.4
[M-H]- 239.99721 149.2
[M+NH4]+ 259.03831 161.4
[M+K]+ 279.96765 152.9
[M+H-H2O]+ 224.00175 139.1
[M+HCOO]- 286.00269 161.8
[M+CH3COO]- 300.01834 186.9
[M+Na-2H]- 261.97916 152.2
[M]+ 241.00394 148.3
[M]- 241.00504 148.3
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.