CID 3071754

Morpholine, 4-(4-(1h-imidazol-1-yl)-2-pyrimidinyl)-, dihydrochloride

Structural Information

Molecular Formula
C11H13N5O
SMILES
C1COCCN1C2=NC=CC(=N2)N3C=CN=C3
InChI
InChI=1S/C11H13N5O/c1-2-13-11(15-5-7-17-8-6-15)14-10(1)16-4-3-12-9-16/h1-4,9H,5-8H2
InChIKey
XCFYLNBPVWCBMI-UHFFFAOYSA-N
Compound name
4-(4-imidazol-1-ylpyrimidin-2-yl)morpholine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.11201 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.11929 151.5
[M+Na]+ 254.10123 165.4
[M+NH4]+ 249.14583 158.4
[M+K]+ 270.07517 161.2
[M-H]- 230.10473 155.5
[M+Na-2H]- 252.08668 159.9
[M]+ 231.11146 154.4
[M]- 231.11256 154.4
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

No patent data available for this compound.