CID 136034529

6-(2-aminoethyl)-2-cyclopropylpyrimidin-4-ol dihydrochloride

Structural Information

Molecular Formula
C9H13N3O
SMILES
C1CC1C2=NC(=CC(=O)N2)CCN
InChI
InChI=1S/C9H13N3O/c10-4-3-7-5-8(13)12-9(11-7)6-1-2-6/h5-6H,1-4,10H2,(H,11,12,13)
InChIKey
MOZWLDYYHNYMDE-UHFFFAOYSA-N
Compound name
4-(2-aminoethyl)-2-cyclopropyl-1H-pyrimidin-6-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

179.10587 Da
Monoisotopic Mass

-0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.11315 139.5
[M+Na]+ 202.09509 152.7
[M+NH4]+ 197.13969 147.2
[M+K]+ 218.06903 148.4
[M-H]- 178.09859 148.3
[M+Na-2H]- 200.08054 148.5
[M]+ 179.10532 144.7
[M]- 179.10642 144.7
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.