CID 135978331

6-(aminomethyl)-2-(pyridin-2-yl)-3,4-dihydropyrimidin-4-one dihydrochloride

Structural Information

Molecular Formula
C10H10N4O
SMILES
C1=CC=NC(=C1)C2=NC(=CC(=O)N2)CN
InChI
InChI=1S/C10H10N4O/c11-6-7-5-9(15)14-10(13-7)8-3-1-2-4-12-8/h1-5H,6,11H2,(H,13,14,15)
InChIKey
WGIFIONSCXTFPY-UHFFFAOYSA-N
Compound name
4-(aminomethyl)-2-pyridin-2-yl-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

202.08546 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.092736 143.6
[M+Na]+ 225.074678 152.9
[M-H]- 201.078184 145.0
[M+NH4]+ 220.119283 157.4
[M+K]+ 241.048618 147.7
[M+H-H2O]+ 185.082720 134.6
[M+HCOO]- 247.083661 164.6
[M+CH3COO]- 261.099311 155.4
[M+Na-2H]- 223.060126 151.4
[M]+ 202.08491142 140.7
[M]- 202.08600858 140.7
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.