CID 68548

Fenquizone

Structural Information

Molecular Formula
C14H12ClN3O3S
SMILES
C1=CC=C(C=C1)C2NC3=CC(=C(C=C3C(=O)N2)S(=O)(=O)N)Cl
InChI
InChI=1S/C14H12ClN3O3S/c15-10-7-11-9(6-12(10)22(16,20)21)14(19)18-13(17-11)8-4-2-1-3-5-8/h1-7,13,17H,(H,18,19)(H2,16,20,21)
InChIKey
DBDTUXMDTSTPQZ-UHFFFAOYSA-N
Compound name
7-chloro-4-oxo-2-phenyl-2,3-dihydro-1H-quinazoline-6-sulfonamide
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

11
References

2199
Patents

337.02878 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.03606 171.9
[M+Na]+ 360.01800 184.8
[M+NH4]+ 355.06260 178.4
[M+K]+ 375.99194 177.2
[M-H]- 336.02150 173.8
[M+Na-2H]- 358.00345 177.4
[M]+ 337.02823 174.8
[M]- 337.02933 174.8
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

patents stripe