CID 477565

1-(2,6-difluorophenyl)-1h,3h-oxazolo(3,4-a)benzimidazole

Structural Information

Molecular Formula
C15H10F2N2O
SMILES
C1C2=NC3=CC=CC=C3N2C(O1)C4=C(C=CC=C4F)F
InChI
InChI=1S/C15H10F2N2O/c16-9-4-3-5-10(17)14(9)15-19-12-7-2-1-6-11(12)18-13(19)8-20-15/h1-7,15H,8H2
InChIKey
ZFDGSRKSJLREJF-UHFFFAOYSA-N
Compound name
1-(2,6-difluorophenyl)-1,3-dihydro-[1,3]oxazolo[3,4-a]benzimidazole
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

272.0761 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 273.08338 156.3
[M+Na]+ 295.06532 169.1
[M-H]- 271.06882 161.8
[M+NH4]+ 290.10992 174.7
[M+K]+ 311.03926 164.2
[M+H-H2O]+ 255.07336 147.3
[M+HCOO]- 317.07430 176.1
[M+CH3COO]- 331.08995 169.6
[M+Na-2H]- 293.05077 160.0
[M]+ 272.07555 157.7
[M]- 272.07665 157.7
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.