CID 15953933

Diphenyl-methanone o-[2-(5-phenoxymethyl-[1,3,4]oxadiazol-2-yl)-ethyl]-oxime

Structural Information

Molecular Formula
C24H21N3O3
SMILES
C1=CC=C(C=C1)C(=NOCCC2=NN=C(O2)COC3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C24H21N3O3/c1-4-10-19(11-5-1)24(20-12-6-2-7-13-20)27-29-17-16-22-25-26-23(30-22)18-28-21-14-8-3-9-15-21/h1-15H,16-18H2
InChIKey
VUYXEUPWCLRVDR-UHFFFAOYSA-N
Compound name
N-[2-[5-(phenoxymethyl)-1,3,4-oxadiazol-2-yl]ethoxy]-1,1-diphenylmethanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

399.1583 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 400.16558 194.8
[M+Na]+ 422.14752 199.4
[M-H]- 398.15102 206.0
[M+NH4]+ 417.19212 202.0
[M+K]+ 438.12146 195.4
[M+H-H2O]+ 382.15556 182.0
[M+HCOO]- 444.15650 217.4
[M+CH3COO]- 458.17215 204.0
[M+Na-2H]- 420.13297 199.0
[M]+ 399.15775 198.1
[M]- 399.15885 198.1
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.