CID 5152318

Butyric n2-(4-chlorophenyl)hydrazide

Structural Information

Molecular Formula

C₁₀H₁₃ClN₂O

SMILES

CCCC(=O)NNC1=CC=C(C=C1)Cl

InChI

InChI=1S/C10H13ClN2O/c1-2-3-10(14)13-12-9-6-4-8(11)5-7-9/h4-7,12H,2-3H2,1H3,(H,13,14)

InChIKey

AOUUNTQHCIVKOX-UHFFFAOYSA-N

Compound name

N'-(4-chlorophenyl)butanehydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 212.07164 Da
Monoisotopic Mass: 2.9
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]+	213.078916	146.0
[M+Na]+	235.060858	153.0
[M-H]-	211.064364	149.4
[M+NH4]+	230.105463	165.1
[M+K]+	251.034798	149.1
[M+H-H2O]+	195.068900	140.4
[M+HCOO]-	257.069841	167.1
[M+CH3COO]-	271.085491	190.4
[M+Na-2H]-	233.046306	151.6
[M]+	212.07109142	147.2
[M]-	212.07218858	147.2

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.