CID 2736015

306935-55-7

Structural Information

Molecular Formula

C₁₀H₇Cl₂N₃

SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=N2)Cl)Cl

InChI

InChI=1S/C10H7Cl2N3/c1-6-8(11)9(12)15-10(14-6)7-4-2-3-5-13-7/h2-5H,1H3

InChIKey

VJJVPBQJWNMJFC-UHFFFAOYSA-N

Compound name

4,5-dichloro-6-methyl-2-pyridin-2-ylpyrimidine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 14
Patents: 239.00171 Da
Monoisotopic Mass: 2.8
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]+	240.00899	148.1
[M+Na]+	261.99093	166.5
[M+NH4]+	257.03553	157.1
[M+K]+	277.96487	157.3
[M-H]-	237.99443	151.7
[M+Na-2H]-	259.97638	158.6
[M]+	239.00116	152.6
[M]-	239.00226	152.6

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe