CID 88425

20241-05-8

Structural Information

Molecular Formula

C₈H₁₀ClN₃

SMILES

CN(C)N=NC1=CC(=CC=C1)Cl

InChI

InChI=1S/C8H10ClN3/c1-12(2)11-10-8-5-3-4-7(9)6-8/h3-6H,1-2H3

InChIKey

XJRXTTURVBVZRR-UHFFFAOYSA-N

Compound name

N-[(3-chlorophenyl)diazenyl]-N-methylmethanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 0
Patents: 183.05632 Da
Monoisotopic Mass: 3.4
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]+	184.06360	136.9
[M+Na]+	206.04554	149.7
[M+NH4]+	201.09014	146.6
[M+K]+	222.01948	142.2
[M-H]-	182.04904	142.2
[M+Na-2H]-	204.03099	146.1
[M]+	183.05577	140.4
[M]-	183.05687	140.4

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.