CID 9554280

Alpha-((3,4-dimethoxyphenyl)methylene)benzeneacetic acid (phenylmethylene)hydrazide

Structural Information

Molecular Formula
C24H22N2O3
SMILES
COC1=C(C=C(C=C1)/C=C(/C2=CC=CC=C2)\C(=O)N/N=C/C3=CC=CC=C3)OC
InChI
InChI=1S/C24H22N2O3/c1-28-22-14-13-19(16-23(22)29-2)15-21(20-11-7-4-8-12-20)24(27)26-25-17-18-9-5-3-6-10-18/h3-17H,1-2H3,(H,26,27)/b21-15-,25-17+
InChIKey
HNVPCSLTMVSASZ-SVIHDTKBSA-N
Compound name
(Z)-N-[(E)-benzylideneamino]-3-(3,4-dimethoxyphenyl)-2-phenylprop-2-enamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

386.16306 Da
Monoisotopic Mass

4.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 387.17034 194.7
[M+Na]+ 409.15228 198.7
[M-H]- 385.15578 204.9
[M+NH4]+ 404.19688 205.2
[M+K]+ 425.12622 194.0
[M+H-H2O]+ 369.16032 183.6
[M+HCOO]- 431.16126 219.5
[M+CH3COO]- 445.17691 226.1
[M+Na-2H]- 407.13773 197.3
[M]+ 386.16251 196.2
[M]- 386.16361 196.2
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.