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

16
Patents

239.00171 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.008986 146.1
[M+Na]+ 261.990928 158.1
[M-H]- 237.994434 148.3
[M+NH4]+ 257.035533 161.2
[M+K]+ 277.964868 151.7
[M+H-H2O]+ 221.998970 137.7
[M+HCOO]- 283.999911 157.6
[M+CH3COO]- 298.015561 158.5
[M+Na-2H]- 259.976376 152.8
[M]+ 239.00116142 149.2
[M]- 239.00225858 149.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe