CID 9574260

4etophcon2 cinn

Structural Information

Molecular Formula
C18H18N2O2
SMILES
CCOC1=CC=C(C=C1)C(=O)N/N=C/C=C/C2=CC=CC=C2
InChI
InChI=1S/C18H18N2O2/c1-2-22-17-12-10-16(11-13-17)18(21)20-19-14-6-9-15-7-4-3-5-8-15/h3-14H,2H2,1H3,(H,20,21)/b9-6+,19-14+
InChIKey
HIQYLTBPWQBELR-NIVQLRFDSA-N
Compound name
4-ethoxy-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

294.13684 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 295.14412 169.7
[M+Na]+ 317.12606 174.8
[M-H]- 293.12956 177.1
[M+NH4]+ 312.17066 184.6
[M+K]+ 333.10000 170.6
[M+H-H2O]+ 277.13410 160.6
[M+HCOO]- 339.13504 196.3
[M+CH3COO]- 353.15069 208.1
[M+Na-2H]- 315.11151 174.9
[M]+ 294.13629 170.8
[M]- 294.13739 170.8
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.