CID 199550

4392-64-7

Structural Information

Molecular Formula
C14H11N3O3S
SMILES
C1=CC=C(C=C1)S(=O)(=O)NN2C=NC3=CC=CC=C3C2=O
InChI
InChI=1S/C14H11N3O3S/c18-14-12-8-4-5-9-13(12)15-10-17(14)16-21(19,20)11-6-2-1-3-7-11/h1-10,16H
InChIKey
IGHDYCHWQZQFGZ-UHFFFAOYSA-N
Compound name
N-(4-oxoquinazolin-3-yl)benzenesulfonamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

301.05212 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.05940 164.8
[M+Na]+ 324.04134 174.9
[M-H]- 300.04484 170.3
[M+NH4]+ 319.08594 178.1
[M+K]+ 340.01528 169.2
[M+H-H2O]+ 284.04938 156.2
[M+HCOO]- 346.05032 181.8
[M+CH3COO]- 360.06597 176.3
[M+Na-2H]- 322.02679 173.5
[M]+ 301.05157 167.5
[M]- 301.05267 167.5
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.