CID 135418296

Quazinone

Structural Information

Molecular Formula
C11H10ClN3O
SMILES
C[C@@H]1C(=O)NC2=NC3=C(CN12)C(=CC=C3)Cl
InChI
InChI=1S/C11H10ClN3O/c1-6-10(16)14-11-13-9-4-2-3-8(12)7(9)5-15(6)11/h2-4,6H,5H2,1H3,(H,13,14,16)/t6-/m1/s1
InChIKey
BHZFZYLBVSWUMT-ZCFIWIBFSA-N
Compound name
(3R)-6-chloro-3-methyl-3,5-dihydro-1H-imidazo[2,1-b]quinazolin-2-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

44
References

980
Patents

235.05124 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 236.05852 151.2
[M+Na]+ 258.04046 162.7
[M-H]- 234.04396 151.5
[M+NH4]+ 253.08506 169.5
[M+K]+ 274.01440 156.3
[M+H-H2O]+ 218.04850 144.0
[M+HCOO]- 280.04944 162.7
[M+CH3COO]- 294.06509 162.9
[M+Na-2H]- 256.02591 155.5
[M]+ 235.05069 151.1
[M]- 235.05179 151.1
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.