CID 28603394

1020955-05-8

Structural Information

Molecular Formula
C10H8F2N2O2
SMILES
C1=CC(=CC=C1C2=NOC(=C2)N)OC(F)F
InChI
InChI=1S/C10H8F2N2O2/c11-10(12)15-7-3-1-6(2-4-7)8-5-9(13)16-14-8/h1-5,10H,13H2
InChIKey
HQVFPPUOUJQDPU-UHFFFAOYSA-N
Compound name
3-[4-(difluoromethoxy)phenyl]-1,2-oxazol-5-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

226.05539 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 227.06267 143.8
[M+Na]+ 249.04461 152.8
[M-H]- 225.04811 147.5
[M+NH4]+ 244.08921 160.4
[M+K]+ 265.01855 151.0
[M+H-H2O]+ 209.05265 134.6
[M+HCOO]- 271.05359 165.8
[M+CH3COO]- 285.06924 189.4
[M+Na-2H]- 247.03006 147.8
[M]+ 226.05484 142.5
[M]- 226.05594 142.5
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.