CID 6870360

N-(2-(2-benzylidenehydrazino)-2-oxoethyl)-3,4-dimethoxybenzamide

Structural Information

Molecular Formula
C18H19N3O4
SMILES
COC1=C(C=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC=CC=C2)OC
InChI
InChI=1S/C18H19N3O4/c1-24-15-9-8-14(10-16(15)25-2)18(23)19-12-17(22)21-20-11-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,19,23)(H,21,22)/b20-11+
InChIKey
ZQZRIHFRIRODQY-RGVLZGJSSA-N
Compound name
N-[2-[(2E)-2-benzylidenehydrazinyl]-2-oxoethyl]-3,4-dimethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

341.13754 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.14482 179.1
[M+Na]+ 364.12676 183.5
[M-H]- 340.13026 186.8
[M+NH4]+ 359.17136 191.7
[M+K]+ 380.10070 181.5
[M+H-H2O]+ 324.13480 169.3
[M+HCOO]- 386.13574 206.1
[M+CH3COO]- 400.15139 219.7
[M+Na-2H]- 362.11221 183.0
[M]+ 341.13699 182.1
[M]- 341.13809 182.1
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.