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]+ 342.10038 180.0
[M+Na]+ 364.08232 188.2
[M-H]- 340.08582 188.9
[M+NH4]+ 359.12692 191.8
[M+K]+ 380.05626 183.6
[M+H-H2O]+ 324.09036 169.5
[M+HCOO]- 386.09130 198.8
[M+CH3COO]- 400.10695 191.1
[M+Na-2H]- 362.06777 183.7
[M]+ 341.09255 185.6
[M]- 341.09365 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.