CID 389386

2-methyl[1,3]oxazolo[4,5-c]quinolin-4(5h)-one

Structural Information

Molecular Formula
C11H8N2O2
SMILES
CC1=NC2=C(O1)C3=CC=CC=C3NC2=O
InChI
InChI=1S/C11H8N2O2/c1-6-12-9-10(15-6)7-4-2-3-5-8(7)13-11(9)14/h2-5H,1H3,(H,13,14)
InChIKey
PVKDPHIJTKZPKN-UHFFFAOYSA-N
Compound name
2-methyl-5H-[1,3]oxazolo[4,5-c]quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

0
Patents

200.05858 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 201.06586 138.3
[M+Na]+ 223.04780 151.5
[M-H]- 199.05130 141.9
[M+NH4]+ 218.09240 157.4
[M+K]+ 239.02174 147.7
[M+H-H2O]+ 183.05584 131.7
[M+HCOO]- 245.05678 159.7
[M+CH3COO]- 259.07243 152.8
[M+Na-2H]- 221.03325 147.8
[M]+ 200.05803 141.9
[M]- 200.05913 141.9
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.