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

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.00899 146.1
[M+Na]+ 261.99093 158.1
[M-H]- 237.99443 148.3
[M+NH4]+ 257.03553 161.2
[M+K]+ 277.96487 151.7
[M+H-H2O]+ 221.99897 137.7
[M+HCOO]- 283.99991 157.6
[M+CH3COO]- 298.01556 158.5
[M+Na-2H]- 259.97638 152.8
[M]+ 239.00116 149.2
[M]- 239.00226 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