CID 19608

3782-80-7

Structural Information

Molecular Formula
C22H19NO2
SMILES
CCOC(=O)C1=CC=C(C=C1)N=CC2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C22H19NO2/c1-2-25-22(24)20-12-14-21(15-13-20)23-16-17-8-10-19(11-9-17)18-6-4-3-5-7-18/h3-16H,2H2,1H3
InChIKey
XCBIEOXLPPQJNF-UHFFFAOYSA-N
Compound name
ethyl 4-[(4-phenylphenyl)methylideneamino]benzoate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6
Patents

329.14157 Da
Monoisotopic Mass

5.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.14885 180.6
[M+Na]+ 352.13079 196.8
[M+NH4]+ 347.17539 189.2
[M+K]+ 368.10473 186.7
[M-H]- 328.13429 188.5
[M+Na-2H]- 350.11624 192.7
[M]+ 329.14102 185.4
[M]- 329.14212 185.4
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

patents stripe