CID 9554273

3,4-dimethoxy-alpha-phenylbenzeneacetic acid (phenylmethylene)hydrazide

Structural Information

Molecular Formula
C24H24N2O3
SMILES
COC1=C(C=C(C=C1)CC(C2=CC=CC=C2)C(=O)N/N=C/C3=CC=CC=C3)OC
InChI
InChI=1S/C24H24N2O3/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/h3-14,16-17,21H,15H2,1-2H3,(H,26,27)/b25-17+
InChIKey
RRZAYFRKELVIBB-KOEQRZSOSA-N
Compound name
N-[(E)-benzylideneamino]-3-(3,4-dimethoxyphenyl)-2-phenylpropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

388.17868 Da
Monoisotopic Mass

4.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.18596 195.4
[M+Na]+ 411.16790 199.0
[M-H]- 387.17140 205.5
[M+NH4]+ 406.21250 205.8
[M+K]+ 427.14184 195.0
[M+H-H2O]+ 371.17594 184.2
[M+HCOO]- 433.17688 220.0
[M+CH3COO]- 447.19253 227.5
[M+Na-2H]- 409.15335 198.0
[M]+ 388.17813 197.7
[M]- 388.17923 197.7
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.