CID 22179283

Furan-3-sulfonamide

Structural Information

Molecular Formula
C4H5NO3S
SMILES
C1=COC=C1S(=O)(=O)N
InChI
InChI=1S/C4H5NO3S/c5-9(6,7)4-1-2-8-3-4/h1-3H,(H2,5,6,7)
InChIKey
XNTWONAICPPJDM-UHFFFAOYSA-N
Compound name
furan-3-sulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

122
Patents

146.99901 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.006286 124.6
[M+Na]+ 169.988228 134.3
[M-H]- 145.991734 129.4
[M+NH4]+ 165.032833 146.4
[M+K]+ 185.962168 133.9
[M+H-H2O]+ 129.996270 120.0
[M+HCOO]- 191.997211 145.3
[M+CH3COO]- 206.012861 169.0
[M+Na-2H]- 167.973676 130.7
[M]+ 146.99846142 126.7
[M]- 146.99955858 126.7
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