CID 45054769

N-(2-(2-(3-methoxybenzylidene)hydrazino)-2-oxoethyl)-4-methylbenzamide

Structural Information

Molecular Formula
C18H19N3O3
SMILES
CC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC(=CC=C2)OC
InChI
InChI=1S/C18H19N3O3/c1-13-6-8-15(9-7-13)18(23)19-12-17(22)21-20-11-14-4-3-5-16(10-14)24-2/h3-11H,12H2,1-2H3,(H,19,23)(H,21,22)/b20-11+
InChIKey
DEMPBLXUJJNDOJ-RGVLZGJSSA-N
Compound name
N-[2-[(2E)-2-[(3-methoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-4-methylbenzamide
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 176.7
[M+Na]+ 348.131858 181.3
[M-H]- 324.135364 184.4
[M+NH4]+ 343.176463 190.1
[M+K]+ 364.105798 178.5
[M+H-H2O]+ 308.139900 167.2
[M+HCOO]- 370.140841 203.4
[M+CH3COO]- 384.156491 217.5
[M+Na-2H]- 346.117306 180.4
[M]+ 325.14209142 178.2
[M]- 325.14318858 178.2
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.