CID 19616624

937597-65-4

Structural Information

Molecular Formula
C17H10N2O4
SMILES
C1=CC=C(C=C1)C2=NOC3=C2C(=CC(=N3)C4=CC=CO4)C(=O)O
InChI
InChI=1S/C17H10N2O4/c20-17(21)11-9-12(13-7-4-8-22-13)18-16-14(11)15(19-23-16)10-5-2-1-3-6-10/h1-9H,(H,20,21)
InChIKey
UVFDODMDTQOIQP-UHFFFAOYSA-N
Compound name
6-(furan-2-yl)-3-phenyl-[1,2]oxazolo[5,4-b]pyridine-4-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

306.06406 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 307.07134 165.5
[M+Na]+ 329.05328 181.3
[M+NH4]+ 324.09788 172.7
[M+K]+ 345.02722 179.6
[M-H]- 305.05678 172.2
[M+Na-2H]- 327.03873 173.5
[M]+ 306.06351 169.8
[M]- 306.06461 169.8
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.