CID 6338079

23505-21-7

Structural Information

Molecular Formula

C₇H₆Cl₂N₂O

SMILES

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

InChI

InChI=1S/C7H6Cl2N2O/c8-4-2-1-3-5(9)6(4)7(10)11-12/h1-3,12H,(H2,10,11)

InChIKey

MULRGOOZFNLPFF-UHFFFAOYSA-N

Compound name

2,6-dichloro-N'-hydroxybenzenecarboximidamide

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 3
References: 48
Patents: 203.98572 Da
Monoisotopic Mass: 1.0
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]+	204.99300	139.0
[M+Na]+	226.97494	148.6
[M-H]-	202.97844	142.1
[M+NH4]+	222.01954	158.8
[M+K]+	242.94888	143.6
[M+H-H2O]+	186.98298	135.2
[M+HCOO]-	248.98392	155.4
[M+CH3COO]-	262.99957	186.6
[M+Na-2H]-	224.96039	143.6
[M]+	203.98517	139.6
[M]-	203.98627	139.6

Literature stripe

literature stripe

Patent stripe

patents stripe