CID 297988

Ethyl imidazo[1,5-a]pyrazine-3-carboxylate

Structural Information

Molecular Formula
C9H9N3O2
SMILES
CCOC(=O)C1=NC=C2N1C=CN=C2
InChI
InChI=1S/C9H9N3O2/c1-2-14-9(13)8-11-6-7-5-10-3-4-12(7)8/h3-6H,2H2,1H3
InChIKey
FGYXTFFJVBIDGA-UHFFFAOYSA-N
Compound name
ethyl imidazo[1,5-a]pyrazine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

191.06947 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 192.076746 138.0
[M+Na]+ 214.058688 148.8
[M-H]- 190.062194 139.3
[M+NH4]+ 209.103293 156.6
[M+K]+ 230.032628 146.6
[M+H-H2O]+ 174.066730 130.1
[M+HCOO]- 236.067671 160.4
[M+CH3COO]- 250.083321 181.2
[M+Na-2H]- 212.044136 145.8
[M]+ 191.06892142 142.3
[M]- 191.07001858 142.3
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

patents stripe