CID 9717567

N-(2-(2-(2,3-dimethoxybenzylidene)hydrazino)-2-oxoethyl)-3,4-dimethoxybenzamide

Structural Information

Molecular Formula
C20H23N3O6
SMILES
COC1=C(C=C(C=C1)C(=O)NCC(=O)N/N=C/C2=C(C(=CC=C2)OC)OC)OC
InChI
InChI=1S/C20H23N3O6/c1-26-15-9-8-13(10-17(15)28-3)20(25)21-12-18(24)23-22-11-14-6-5-7-16(27-2)19(14)29-4/h5-11H,12H2,1-4H3,(H,21,25)(H,23,24)/b22-11+
InChIKey
FLJHGEUIGQITQO-SSDVNMTOSA-N
Compound name
N-[2-[(2E)-2-[(2,3-dimethoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-3,4-dimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

401.1587 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 402.16598 193.2
[M+Na]+ 424.14792 198.0
[M-H]- 400.15142 201.2
[M+NH4]+ 419.19252 203.7
[M+K]+ 440.12186 197.3
[M+H-H2O]+ 384.15596 182.9
[M+HCOO]- 446.15690 219.7
[M+CH3COO]- 460.17255 232.8
[M+Na-2H]- 422.13337 195.0
[M]+ 401.15815 200.4
[M]- 401.15925 200.4
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

No patent data available for this compound.