CID 67043330

7-fluoro-1,3-benzoxazol-2-amine

Structural Information

Molecular Formula
C7H5FN2O
SMILES
C1=CC2=C(C(=C1)F)OC(=N2)N
InChI
InChI=1S/C7H5FN2O/c8-4-2-1-3-5-6(4)11-7(9)10-5/h1-3H,(H2,9,10)
InChIKey
WUHCQEXONBXTHQ-UHFFFAOYSA-N
Compound name
7-fluoro-1,3-benzoxazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

13
Patents

152.03859 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.04587 123.5
[M+Na]+ 175.02781 135.5
[M-H]- 151.03131 126.9
[M+NH4]+ 170.07241 145.0
[M+K]+ 191.00175 133.6
[M+H-H2O]+ 135.03585 116.9
[M+HCOO]- 197.03679 148.3
[M+CH3COO]- 211.05244 138.9
[M+Na-2H]- 173.01326 132.7
[M]+ 152.03804 124.3
[M]- 152.03914 124.3
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

patents stripe