CID 9650196

N'-(2,4-dichlorobenzylidene)-2-(3-toluidino)acetohydrazide

Structural Information

Molecular Formula
C16H15Cl2N3O
SMILES
CC1=CC(=CC=C1)NCC(=O)N/N=C/C2=C(C=C(C=C2)Cl)Cl
InChI
InChI=1S/C16H15Cl2N3O/c1-11-3-2-4-14(7-11)19-10-16(22)21-20-9-12-5-6-13(17)8-15(12)18/h2-9,19H,10H2,1H3,(H,21,22)/b20-9+
InChIKey
AHPHELDBQXYRJE-AWQFTUOYSA-N
Compound name
N-[(E)-(2,4-dichlorophenyl)methylideneamino]-2-(3-methylanilino)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

335.0592 Da
Monoisotopic Mass

4.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.06648 178.0
[M+Na]+ 358.04842 185.9
[M-H]- 334.05192 185.2
[M+NH4]+ 353.09302 193.0
[M+K]+ 374.02236 179.1
[M+H-H2O]+ 318.05646 171.0
[M+HCOO]- 380.05740 196.1
[M+CH3COO]- 394.07305 216.6
[M+Na-2H]- 356.03387 181.5
[M]+ 335.05865 181.6
[M]- 335.05975 181.6
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.