CID 24694666

5-(2,3-dimethoxyphenyl)-1,3,4-oxadiazol-2-amine

Structural Information

Molecular Formula
C10H11N3O3
SMILES
COC1=CC=CC(=C1OC)C2=NN=C(O2)N
InChI
InChI=1S/C10H11N3O3/c1-14-7-5-3-4-6(8(7)15-2)9-12-13-10(11)16-9/h3-5H,1-2H3,(H2,11,13)
InChIKey
MUHOWTKEFHYBKI-UHFFFAOYSA-N
Compound name
5-(2,3-dimethoxyphenyl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

221.08005 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.087326 145.6
[M+Na]+ 244.069268 155.7
[M-H]- 220.072774 151.0
[M+NH4]+ 239.113873 161.6
[M+K]+ 260.043208 154.7
[M+H-H2O]+ 204.077310 137.5
[M+HCOO]- 266.078251 169.6
[M+CH3COO]- 280.093901 189.2
[M+Na-2H]- 242.054716 151.2
[M]+ 221.07950142 149.5
[M]- 221.08059858 149.5
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.