CID 312914

Furodazole

Structural Information

Molecular Formula
C15H11N3O2
SMILES
CC1=CC(=O)C2=C(N1)C=CC3=C2N=C(N3)C4=CC=CO4
InChI
InChI=1S/C15H11N3O2/c1-8-7-11(19)13-9(16-8)4-5-10-14(13)18-15(17-10)12-3-2-6-20-12/h2-7H,1H3,(H,16,19)(H,17,18)
InChIKey
NYRSQWAKUMYFLI-UHFFFAOYSA-N
Compound name
2-(furan-2-yl)-7-methyl-3,6-dihydroimidazo[4,5-f]quinolin-9-one
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

2
References

114
Patents

265.0851 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.092376 156.8
[M+Na]+ 288.074318 170.7
[M-H]- 264.077824 162.0
[M+NH4]+ 283.118923 173.0
[M+K]+ 304.048258 164.7
[M+H-H2O]+ 248.082360 149.6
[M+HCOO]- 310.083301 177.5
[M+CH3COO]- 324.098951 170.1
[M+Na-2H]- 286.059766 162.7
[M]+ 265.08455142 160.8
[M]- 265.08564858 160.8
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