CID 9639329

N-(2-(2-(2-chlorobenzylidene)hydrazino)-2-oxoethyl)-4-propoxybenzamide

Structural Information

Molecular Formula
C19H20ClN3O3
SMILES
CCCOC1=CC=C(C=C1)C(=O)NCC(=O)N/N=C/C2=CC=CC=C2Cl
InChI
InChI=1S/C19H20ClN3O3/c1-2-11-26-16-9-7-14(8-10-16)19(25)21-13-18(24)23-22-12-15-5-3-4-6-17(15)20/h3-10,12H,2,11,13H2,1H3,(H,21,25)(H,23,24)/b22-12+
InChIKey
TZGNUXGTHKYNBO-WSDLNYQXSA-N
Compound name
N-[2-[(2E)-2-[(2-chlorophenyl)methylidene]hydrazinyl]-2-oxoethyl]-4-propoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

373.11932 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 374.12660 188.6
[M+Na]+ 396.10854 199.7
[M+NH4]+ 391.15314 194.6
[M+K]+ 412.08248 192.1
[M-H]- 372.11204 193.1
[M+Na-2H]- 394.09399 195.7
[M]+ 373.11877 191.4
[M]- 373.11987 191.4
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.