CID 9639561

N-(2-(2-benzylidenehydrazino)-2-oxoethyl)-4-ethoxybenzamide

Structural Information

Molecular Formula
C18H19N3O3
SMILES
CCOC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC=CC=C2
InChI
InChI=1S/C18H19N3O3/c1-2-24-16-10-8-15(9-11-16)18(23)19-13-17(22)21-20-12-14-6-4-3-5-7-14/h3-12H,2,13H2,1H3,(H,19,23)(H,21,22)/b20-12+
InChIKey
KMWJRHNAWGCAGT-UDWIEESQSA-N
Compound name
N-[2-[(2E)-2-benzylidenehydrazinyl]-2-oxoethyl]-4-ethoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

325.14264 Da
Monoisotopic Mass

2.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 326.149916 176.2
[M+Na]+ 348.131858 179.9
[M-H]- 324.135364 183.6
[M+NH4]+ 343.176463 189.3
[M+K]+ 364.105798 177.1
[M+H-H2O]+ 308.139900 166.5
[M+HCOO]- 370.140841 203.0
[M+CH3COO]- 384.156491 216.3
[M+Na-2H]- 346.117306 180.8
[M]+ 325.14209142 177.4
[M]- 325.14318858 177.4
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.