CID 43559293

1306604-81-8

Structural Information

Molecular Formula
C10H10FN3O
SMILES
CC1=NC(=NO1)C(C2=CC=CC=C2F)N
InChI
InChI=1S/C10H10FN3O/c1-6-13-10(14-15-6)9(12)7-4-2-3-5-8(7)11/h2-5,9H,12H2,1H3
InChIKey
AGVCUJHDNMDSGD-UHFFFAOYSA-N
Compound name
(2-fluorophenyl)-(5-methyl-1,2,4-oxadiazol-3-yl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

207.0808 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.088076 142.8
[M+Na]+ 230.070018 152.0
[M-H]- 206.073524 146.5
[M+NH4]+ 225.114623 159.0
[M+K]+ 246.043958 149.9
[M+H-H2O]+ 190.078060 133.8
[M+HCOO]- 252.079001 164.3
[M+CH3COO]- 266.094651 187.3
[M+Na-2H]- 228.055466 147.3
[M]+ 207.08025142 141.7
[M]- 207.08134858 141.7
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.