CID 13266666

Imidazo(1,5-a)pyrazin-3(2h)-one, hexahydro-7-phenyl-2-(2-propenyl)-, monohydrochloride

Structural Information

Molecular Formula
C15H19N3O
SMILES
C=CCN1CC2CN(CCN2C1=O)C3=CC=CC=C3
InChI
InChI=1S/C15H19N3O/c1-2-8-17-12-14-11-16(9-10-18(14)15(17)19)13-6-4-3-5-7-13/h2-7,14H,1,8-12H2
InChIKey
QCLKYBWYOSBSDN-UHFFFAOYSA-N
Compound name
7-phenyl-2-prop-2-enyl-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazin-3-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

257.1528 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 258.160076 162.5
[M+Na]+ 280.142018 169.2
[M-H]- 256.145524 165.1
[M+NH4]+ 275.186623 177.9
[M+K]+ 296.115958 164.1
[M+H-H2O]+ 240.150060 152.9
[M+HCOO]- 302.151001 177.8
[M+CH3COO]- 316.166651 172.6
[M+Na-2H]- 278.127466 163.7
[M]+ 257.15225142 158.3
[M]- 257.15334858 158.3
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

No patent data available for this compound.