CID 139022471

2344678-81-3

Structural Information

Molecular Formula
C9H11N3O2
SMILES
CCOC(=O)C1=CN2C=NC=C2NC1
InChI
InChI=1S/C9H11N3O2/c1-2-14-9(13)7-3-11-8-4-10-6-12(8)5-7/h4-6,11H,2-3H2,1H3
InChIKey
XCKWQQPJUGFOGB-UHFFFAOYSA-N
Compound name
ethyl 1,2-dihydroimidazo[1,5-a]pyrimidine-3-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

193.08513 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.09241 141.8
[M+Na]+ 216.07435 152.6
[M+NH4]+ 211.11895 148.5
[M+K]+ 232.04829 149.5
[M-H]- 192.07785 140.7
[M+Na-2H]- 214.05980 145.5
[M]+ 193.08458 142.6
[M]- 193.08568 142.6
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.