CID 726944

52727-44-3

Structural Information

Molecular Formula
C10H8N2O2
SMILES
C1COC2=NC3=CC=CC=C3C(=O)N21
InChI
InChI=1S/C10H8N2O2/c13-9-7-3-1-2-4-8(7)11-10-12(9)5-6-14-10/h1-4H,5-6H2
InChIKey
QBEBJBXQJGORQQ-UHFFFAOYSA-N
Compound name
2,3-dihydro-[1,3]oxazolo[2,3-b]quinazolin-5-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

11
References

11
Patents

188.05858 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.06586 134.8
[M+Na]+ 211.04780 145.8
[M-H]- 187.05130 138.7
[M+NH4]+ 206.09240 154.6
[M+K]+ 227.02174 143.5
[M+H-H2O]+ 171.05584 127.7
[M+HCOO]- 233.05678 155.2
[M+CH3COO]- 247.07243 149.0
[M+Na-2H]- 209.03325 144.0
[M]+ 188.05803 136.5
[M]- 188.05913 136.5
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.