CID 3653204

3797-81-7

Structural Information

Molecular Formula

C₇H₆Cl₂N₂

SMILES

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

InChI

InChI=1S/C7H6Cl2N2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H3,10,11)

InChIKey

PQVLZHJNFSEYOS-UHFFFAOYSA-N

Compound name

2,6-dichlorobenzenecarboximidamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 4
Patents: 187.9908 Da
Monoisotopic Mass: 0.9
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]+	188.99808	136.3
[M+Na]+	210.98002	145.8
[M-H]-	186.98352	139.3
[M+NH4]+	206.02462	156.6
[M+K]+	226.95396	140.2
[M+H-H2O]+	170.98806	132.7
[M+HCOO]-	232.98900	152.4
[M+CH3COO]-	247.00465	185.2
[M+Na-2H]-	208.96547	140.9
[M]+	187.99025	135.5
[M]-	187.99135	135.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe