CID 15954116

1,1-diphenyl-n-[2-[5-[(e)-styryl]-1,3,4-oxadiazol-2-yl]ethoxy]methanimine

Structural Information

Molecular Formula
C25H21N3O2
SMILES
C1=CC=C(C=C1)/C=C/C2=NN=C(O2)CCON=C(C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C25H21N3O2/c1-4-10-20(11-5-1)16-17-23-26-27-24(30-23)18-19-29-28-25(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-17H,18-19H2/b17-16+
InChIKey
SFTGTFWLYLJPKV-WUKNDPDISA-N
Compound name
1,1-diphenyl-N-[2-[5-[(E)-2-phenylethenyl]-1,3,4-oxadiazol-2-yl]ethoxy]methanimine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

395.1634 Da
Monoisotopic Mass

6.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 396.17068 196.5
[M+Na]+ 418.15262 201.4
[M-H]- 394.15612 207.5
[M+NH4]+ 413.19722 204.0
[M+K]+ 434.12656 195.8
[M+H-H2O]+ 378.16066 183.8
[M+HCOO]- 440.16160 218.8
[M+CH3COO]- 454.17725 205.5
[M+Na-2H]- 416.13807 200.0
[M]+ 395.16285 198.1
[M]- 395.16395 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.