CID 130569656

2,4-dichloro-6-[(1-methyl-1h-pyrazol-4-yl)oxy]pyrimidine

Structural Information

Molecular Formula
C8H6Cl2N4O
SMILES
CN1C=C(C=N1)OC2=CC(=NC(=N2)Cl)Cl
InChI
InChI=1S/C8H6Cl2N4O/c1-14-4-5(3-11-14)15-7-2-6(9)12-8(10)13-7/h2-4H,1H3
InChIKey
OCQVHUJZECFMCH-UHFFFAOYSA-N
Compound name
2,4-dichloro-6-(1-methylpyrazol-4-yl)oxypyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

243.99187 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 244.99915 146.4
[M+Na]+ 266.98109 158.8
[M-H]- 242.98459 147.6
[M+NH4]+ 262.02569 161.5
[M+K]+ 282.95503 153.7
[M+H-H2O]+ 226.98913 137.2
[M+HCOO]- 288.99007 158.0
[M+CH3COO]- 303.00572 158.8
[M+Na-2H]- 264.96654 151.0
[M]+ 243.99132 150.9
[M]- 243.99242 150.9
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.

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No patent data available for this compound.