CID 88063

19436-42-1

Structural Information

Molecular Formula

C₁₀H₁₃ClN₂O

SMILES

CC(C)NNC(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C10H13ClN2O/c1-7(2)12-13-10(14)8-3-5-9(11)6-4-8/h3-7,12H,1-2H3,(H,13,14)

InChIKey

QHZLYJFTHWJCAB-UHFFFAOYSA-N

Compound name

4-chloro-N'-propan-2-ylbenzohydrazide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 5
Patents: 212.07164 Da
Monoisotopic Mass: 2.4
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	146.3
[M+Na]+	235.060858	153.1
[M-H]-	211.064364	149.9
[M+NH4]+	230.105463	165.4
[M+K]+	251.034798	149.7
[M+H-H2O]+	195.068900	140.9
[M+HCOO]-	257.069841	166.5
[M+CH3COO]-	271.085491	191.2
[M+Na-2H]-	233.046306	150.8
[M]+	212.07109142	146.9
[M]-	212.07218858	146.9

Literature stripe

literature stripe

Patent stripe

patents stripe