CID 122198966

2-[2-(pyrrolidin-1-yl)pyrimidin-4-yl]morpholine

Structural Information

Molecular Formula
C12H18N4O
SMILES
C1CCN(C1)C2=NC=CC(=N2)C3CNCCO3
InChI
InChI=1S/C12H18N4O/c1-2-7-16(6-1)12-14-4-3-10(15-12)11-9-13-5-8-17-11/h3-4,11,13H,1-2,5-9H2
InChIKey
PYZGXBIDCLDUBO-UHFFFAOYSA-N
Compound name
2-(2-pyrrolidin-1-ylpyrimidin-4-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

234.14806 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 235.15534 155.9
[M+Na]+ 257.13728 167.4
[M+NH4]+ 252.18188 163.0
[M+K]+ 273.11122 163.4
[M-H]- 233.14078 159.8
[M+Na-2H]- 255.12273 162.1
[M]+ 234.14751 158.3
[M]- 234.14861 158.3
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.