CID 63048941

5-(5-fluoro-2-methylphenyl)-1,3,4-oxadiazol-2-amine

Structural Information

Molecular Formula
C9H8FN3O
SMILES
CC1=C(C=C(C=C1)F)C2=NN=C(O2)N
InChI
InChI=1S/C9H8FN3O/c1-5-2-3-6(10)4-7(5)8-12-13-9(11)14-8/h2-4H,1H3,(H2,11,13)
InChIKey
FYADMHIGMTXZII-UHFFFAOYSA-N
Compound name
5-(5-fluoro-2-methylphenyl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.06514 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.07242 137.9
[M+Na]+ 216.05436 148.8
[M-H]- 192.05786 142.1
[M+NH4]+ 211.09896 155.2
[M+K]+ 232.02830 146.4
[M+H-H2O]+ 176.06240 129.4
[M+HCOO]- 238.06334 160.8
[M+CH3COO]- 252.07899 151.8
[M+Na-2H]- 214.03981 143.4
[M]+ 193.06459 137.5
[M]- 193.06569 137.5
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.