CID 2763624

5734-68-9

Structural Information

Molecular Formula

C₆H₇Cl₂N₃

SMILES

CN(C)C1=NC(=CC(=N1)Cl)Cl

InChI

InChI=1S/C6H7Cl2N3/c1-11(2)6-9-4(7)3-5(8)10-6/h3H,1-2H3

InChIKey

PWJNRLSPEYCEMV-UHFFFAOYSA-N

Compound name

4,6-dichloro-N,N-dimethylpyrimidin-2-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 41
Patents: 191.00171 Da
Monoisotopic Mass: 2.6
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]+	192.00899	134.0
[M+Na]+	213.99093	144.8
[M-H]-	189.99443	136.0
[M+NH4]+	209.03553	152.9
[M+K]+	229.96487	141.3
[M+H-H2O]+	173.99897	127.9
[M+HCOO]-	235.99991	148.5
[M+CH3COO]-	250.01556	186.8
[M+Na-2H]-	211.97638	140.7
[M]+	191.00116	137.7
[M]-	191.00226	137.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe