CID 3011948

5-(benzenesulfonyl)-n-(3-hydroxyphenyl)furan-2-carboxamide

Structural Information

Molecular Formula
C17H13NO5S
SMILES
C1=CC=C(C=C1)S(=O)(=O)C2=CC=C(O2)C(=O)NC3=CC(=CC=C3)O
InChI
InChI=1S/C17H13NO5S/c19-13-6-4-5-12(11-13)18-17(20)15-9-10-16(23-15)24(21,22)14-7-2-1-3-8-14/h1-11,19H,(H,18,20)
InChIKey
YJYIEJQPDNVPCV-UHFFFAOYSA-N
Compound name
5-(benzenesulfonyl)-N-(3-hydroxyphenyl)furan-2-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

343.05145 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 344.05873 176.7
[M+Na]+ 366.04067 184.5
[M-H]- 342.04417 186.8
[M+NH4]+ 361.08527 189.6
[M+K]+ 382.01461 181.2
[M+H-H2O]+ 326.04871 169.7
[M+HCOO]- 388.04965 195.1
[M+CH3COO]- 402.06530 204.5
[M+Na-2H]- 364.02612 180.2
[M]+ 343.05090 180.1
[M]- 343.05200 180.1
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.