CID 387468

Nsc681272

Structural Information

Molecular Formula
C16H10N2O2
SMILES
C1=CC=C(C=C1)C2=NC3=C(O2)C4=CC=CC=C4NC3=O
InChI
InChI=1S/C16H10N2O2/c19-15-13-14(11-8-4-5-9-12(11)17-15)20-16(18-13)10-6-2-1-3-7-10/h1-9H,(H,17,19)
InChIKey
WEVBZMVDUUWBJH-UHFFFAOYSA-N
Compound name
2-phenyl-5H-[1,3]oxazolo[4,5-c]quinolin-4-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

11
Patents

262.07422 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 263.08150 155.7
[M+Na]+ 285.06344 167.9
[M-H]- 261.06694 162.3
[M+NH4]+ 280.10804 171.6
[M+K]+ 301.03738 162.4
[M+H-H2O]+ 245.07148 147.3
[M+HCOO]- 307.07242 176.6
[M+CH3COO]- 321.08807 168.9
[M+Na-2H]- 283.04889 164.6
[M]+ 262.07367 158.3
[M]- 262.07477 158.3
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