CID 15953929

Ethanone, 1-phenyl-, o-[2-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]ethyl]oxime, (1e)-

Structural Information

Molecular Formula
C18H16ClN3O2
SMILES
C/C(=N\OCCC1=NN=C(O1)C2=CC=C(C=C2)Cl)/C3=CC=CC=C3
InChI
InChI=1S/C18H16ClN3O2/c1-13(14-5-3-2-4-6-14)22-23-12-11-17-20-21-18(24-17)15-7-9-16(19)10-8-15/h2-10H,11-12H2,1H3/b22-13+
InChIKey
ZUVVMUOYUHSYLH-LPYMAVHISA-N
Compound name
(E)-N-[2-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]ethoxy]-1-phenylethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.0931 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.100376 180.0
[M+Na]+ 364.082318 188.2
[M-H]- 340.085824 188.9
[M+NH4]+ 359.126923 191.8
[M+K]+ 380.056258 183.6
[M+H-H2O]+ 324.090360 169.5
[M+HCOO]- 386.091301 198.8
[M+CH3COO]- 400.106951 191.1
[M+Na-2H]- 362.067766 183.7
[M]+ 341.09255142 185.6
[M]- 341.09364858 185.6
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.