CID 13861570

2-chloro-4-(2-methoxyethoxy)pyrimidine

Structural Information

Molecular Formula
C7H9ClN2O2
SMILES
COCCOC1=NC(=NC=C1)Cl
InChI
InChI=1S/C7H9ClN2O2/c1-11-4-5-12-6-2-3-9-7(8)10-6/h2-3H,4-5H2,1H3
InChIKey
SRILHJIMBYGENK-UHFFFAOYSA-N
Compound name
2-chloro-4-(2-methoxyethoxy)pyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

188.03525 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.04253 134.4
[M+Na]+ 211.02447 144.2
[M-H]- 187.02797 135.3
[M+NH4]+ 206.06907 152.4
[M+K]+ 226.99841 141.7
[M+H-H2O]+ 171.03251 127.6
[M+HCOO]- 233.03345 152.8
[M+CH3COO]- 247.04910 179.7
[M+Na-2H]- 209.00992 142.6
[M]+ 188.03470 139.6
[M]- 188.03580 139.6
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