CID 15954328

(1e)-1-phenylethanone o-{2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl}oxime

Structural Information

Molecular Formula
C19H19N3O3
SMILES
C/C(=N\OCCC1=NN=C(O1)C2=CC=C(C=C2)OC)/C3=CC=CC=C3
InChI
InChI=1S/C19H19N3O3/c1-14(15-6-4-3-5-7-15)22-24-13-12-18-20-21-19(25-18)16-8-10-17(23-2)11-9-16/h3-11H,12-13H2,1-2H3/b22-14+
InChIKey
CEXIPTSRFVWNKL-HYARGMPZSA-N
Compound name
(E)-N-[2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethoxy]-1-phenylethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.14264 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.14992 179.5
[M+Na]+ 360.13186 186.3
[M-H]- 336.13536 188.6
[M+NH4]+ 355.17646 190.5
[M+K]+ 376.10580 183.8
[M+H-H2O]+ 320.13990 168.6
[M+HCOO]- 382.14084 203.0
[M+CH3COO]- 396.15649 213.3
[M+Na-2H]- 358.11731 183.5
[M]+ 337.14209 184.7
[M]- 337.14319 184.7
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.