CID 218043

Brn 1040536

Structural Information

Molecular Formula
C16H13Cl2N3O3
SMILES
COC1=CC=CC(=C1)NC2=NN=C(O2)COC3=C(C=CC(=C3)Cl)Cl
InChI
InChI=1S/C16H13Cl2N3O3/c1-22-12-4-2-3-11(8-12)19-16-21-20-15(24-16)9-23-14-7-10(17)5-6-13(14)18/h2-8H,9H2,1H3,(H,19,21)
InChIKey
CFOVCPWINZVKBV-UHFFFAOYSA-N
Compound name
5-[(2,5-dichlorophenoxy)methyl]-N-(3-methoxyphenyl)-1,3,4-oxadiazol-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

365.0334 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 366.04068 181.0
[M+Na]+ 388.02262 197.4
[M+NH4]+ 383.06722 188.4
[M+K]+ 403.99656 190.8
[M-H]- 364.02612 187.3
[M+Na-2H]- 386.00807 190.0
[M]+ 365.03285 185.8
[M]- 365.03395 185.8
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.