CID 44630668

2,4-dichlorofuro[2,3-d]pyrimidine

Structural Information

Molecular Formula
C6H2Cl2N2O
SMILES
C1=COC2=C1C(=NC(=N2)Cl)Cl
InChI
InChI=1S/C6H2Cl2N2O/c7-4-3-1-2-11-5(3)10-6(8)9-4/h1-2H
InChIKey
RJHMENBSHWUDOO-UHFFFAOYSA-N
Compound name
2,4-dichlorofuro[2,3-d]pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

187.95442 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 188.96170 129.9
[M+Na]+ 210.94364 143.9
[M-H]- 186.94714 132.6
[M+NH4]+ 205.98824 150.2
[M+K]+ 226.91758 140.1
[M+H-H2O]+ 170.95168 124.3
[M+HCOO]- 232.95262 144.0
[M+CH3COO]- 246.96827 144.8
[M+Na-2H]- 208.92909 138.9
[M]+ 187.95387 136.1
[M]- 187.95497 136.1
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