CID 5795686

88584-39-8

Structural Information

Molecular Formula
C21H18N2O
SMILES
CC1=NOC(=C1N=C/C=C/C2=CC=CC=C2)/C=C/C3=CC=CC=C3
InChI
InChI=1S/C21H18N2O/c1-17-21(22-16-8-13-18-9-4-2-5-10-18)20(24-23-17)15-14-19-11-6-3-7-12-19/h2-16H,1H3/b13-8+,15-14+,22-16?
InChIKey
YNQDRYLGPJQGDJ-QOCROZFYSA-N
Compound name
(E)-N-[3-methyl-5-[(E)-2-phenylethenyl]-1,2-oxazol-4-yl]-3-phenylprop-2-en-1-imine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

314.1419 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 315.14918 177.7
[M+Na]+ 337.13112 193.1
[M+NH4]+ 332.17572 185.6
[M+K]+ 353.10506 184.8
[M-H]- 313.13462 185.6
[M+Na-2H]- 335.11657 187.8
[M]+ 314.14135 182.2
[M]- 314.14245 182.2
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.