CID 292562

2-(2,6-dichlorophenyl)-1,2-dihydro-4(3h)-quinazolinone

Structural Information

Molecular Formula
C14H10Cl2N2O
SMILES
C1=CC=C2C(=C1)C(=O)NC(N2)C3=C(C=CC=C3Cl)Cl
InChI
InChI=1S/C14H10Cl2N2O/c15-9-5-3-6-10(16)12(9)13-17-11-7-2-1-4-8(11)14(19)18-13/h1-7,13,17H,(H,18,19)
InChIKey
XNEJBORZTLAGGQ-UHFFFAOYSA-N
Compound name
2-(2,6-dichlorophenyl)-2,3-dihydro-1H-quinazolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

292.01703 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.02431 161.4
[M+Na]+ 315.00625 171.5
[M-H]- 291.00975 162.8
[M+NH4]+ 310.05085 175.2
[M+K]+ 330.98019 162.6
[M+H-H2O]+ 275.01429 154.1
[M+HCOO]- 337.01523 167.6
[M+CH3COO]- 351.03088 171.4
[M+Na-2H]- 312.99170 165.5
[M]+ 292.01648 159.4
[M]- 292.01758 159.4
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.