CID 6485369

7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Structural Information

Molecular Formula
C11H7N3O3
SMILES
C1=COC(=C1)C2=CC=NC3=CC(=NN23)C(=O)O
InChI
InChI=1S/C11H7N3O3/c15-11(16)7-6-10-12-4-3-8(14(10)13-7)9-2-1-5-17-9/h1-6H,(H,15,16)
InChIKey
WVANFBWIAZCONH-UHFFFAOYSA-N
Compound name
7-(furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

0
Patents

229.04874 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 230.05602 144.9
[M+Na]+ 252.03796 156.3
[M-H]- 228.04146 149.7
[M+NH4]+ 247.08256 161.4
[M+K]+ 268.01190 154.1
[M+H-H2O]+ 212.04600 137.4
[M+HCOO]- 274.04694 166.6
[M+CH3COO]- 288.06259 158.6
[M+Na-2H]- 250.02341 150.4
[M]+ 229.04819 148.9
[M]- 229.04929 148.9
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.