CID 131292946

Methyl 3-formyl-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate

Structural Information

Molecular Formula
C10H9N3O3
SMILES
CC1=NN2C=C(C=NC2=C1C=O)C(=O)OC
InChI
InChI=1S/C10H9N3O3/c1-6-8(5-14)9-11-3-7(10(15)16-2)4-13(9)12-6/h3-5H,1-2H3
InChIKey
BVOYOHLYMGRQGY-UHFFFAOYSA-N
Compound name
methyl 3-formyl-2-methylpyrazolo[1,5-a]pyrimidine-6-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

219.06439 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 220.07167 144.3
[M+Na]+ 242.05361 156.6
[M-H]- 218.05711 146.3
[M+NH4]+ 237.09821 162.2
[M+K]+ 258.02755 154.1
[M+H-H2O]+ 202.06165 136.8
[M+HCOO]- 264.06259 166.7
[M+CH3COO]- 278.07824 187.8
[M+Na-2H]- 240.03906 150.2
[M]+ 219.06384 150.5
[M]- 219.06494 150.5
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.