CID 28566

17473-76-6

Structural Information

Molecular Formula

C₁₃H₁₁ClN₂O

SMILES

C1=CC=C(C=C1)C(=O)NNC2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H11ClN2O/c14-11-6-8-12(9-7-11)15-16-13(17)10-4-2-1-3-5-10/h1-9,15H,(H,16,17)

InChIKey

JQDUOCCITWQNES-UHFFFAOYSA-N

Compound name

N'-(4-chlorophenyl)benzohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 1
Patents: 246.05598 Da
Monoisotopic Mass: 3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	247.06326	153.8
[M+Na]+	269.04520	167.9
[M+NH4]+	264.08980	162.9
[M+K]+	285.01914	159.6
[M-H]-	245.04870	159.5
[M+Na-2H]-	267.03065	164.0
[M]+	246.05543	157.7
[M]-	246.05653	157.7

Literature stripe

literature stripe

Patent stripe

patents stripe