CID 116706133

4-chloro-2-(1-methoxycyclobutyl)-6-methylpyrimidine

Structural Information

Molecular Formula
C10H13ClN2O
SMILES
CC1=CC(=NC(=N1)C2(CCC2)OC)Cl
InChI
InChI=1S/C10H13ClN2O/c1-7-6-8(11)13-9(12-7)10(14-2)4-3-5-10/h6H,3-5H2,1-2H3
InChIKey
ZHXMAQZJJFDXNR-UHFFFAOYSA-N
Compound name
4-chloro-2-(1-methoxycyclobutyl)-6-methylpyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.07164 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.07892 138.3
[M+Na]+ 235.06086 148.5
[M+NH4]+ 230.10546 144.5
[M+K]+ 251.03480 141.8
[M-H]- 211.06436 138.4
[M+Na-2H]- 233.04631 145.5
[M]+ 212.07109 139.1
[M]- 212.07219 139.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

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No literature data available for this compound.

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No patent data available for this compound.