CID 130139910

5-(dimethylamino)pyrimidine-2-carboxylic acid

Structural Information

Molecular Formula
C7H9N3O2
SMILES
CN(C)C1=CN=C(N=C1)C(=O)O
InChI
InChI=1S/C7H9N3O2/c1-10(2)5-3-8-6(7(11)12)9-4-5/h3-4H,1-2H3,(H,11,12)
InChIKey
AFJPGYSJMMHNKR-UHFFFAOYSA-N
Compound name
5-(dimethylamino)pyrimidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

167.06947 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.07675 133.4
[M+Na]+ 190.05869 144.8
[M+NH4]+ 185.10329 140.0
[M+K]+ 206.03263 140.9
[M-H]- 166.06219 133.7
[M+Na-2H]- 188.04414 139.4
[M]+ 167.06892 134.8
[M]- 167.07002 134.8
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.