CID 28938024

5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-amine

Structural Information

Molecular Formula
C10H9N3O3
SMILES
C1COC2=C(O1)C=CC(=C2)C3=NN=C(O3)N
InChI
InChI=1S/C10H9N3O3/c11-10-13-12-9(16-10)6-1-2-7-8(5-6)15-4-3-14-7/h1-2,5H,3-4H2,(H2,11,13)
InChIKey
OGKQGHXOQYDRAM-UHFFFAOYSA-N
Compound name
5-(2,3-dihydro-1,4-benzodioxin-6-yl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

219.06439 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.07167 145.5
[M+Na]+ 242.05361 158.9
[M+NH4]+ 237.09821 153.3
[M+K]+ 258.02755 156.3
[M-H]- 218.05711 152.5
[M+Na-2H]- 240.03906 150.7
[M]+ 219.06384 149.4
[M]- 219.06494 149.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.