CID 135528024

3-phenylimidazo[1,5-a]pyrazin-1-ol hydrochloride

Structural Information

Molecular Formula
C12H9N3O
SMILES
C1=CC=C(C=C1)C2=NC(=C3N2C=CN=C3)O
InChI
InChI=1S/C12H9N3O/c16-12-10-8-13-6-7-15(10)11(14-12)9-4-2-1-3-5-9/h1-8,16H
InChIKey
YPHLIGIVYATIKO-UHFFFAOYSA-N
Compound name
3-phenylimidazo[1,5-a]pyrazin-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

211.07455 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 212.081826 143.5
[M+Na]+ 234.063768 154.9
[M-H]- 210.067274 147.0
[M+NH4]+ 229.108373 160.5
[M+K]+ 250.037708 149.7
[M+H-H2O]+ 194.071810 134.9
[M+HCOO]- 256.072751 165.4
[M+CH3COO]- 270.088401 156.8
[M+Na-2H]- 232.049216 152.0
[M]+ 211.07400142 144.8
[M]- 211.07509858 144.8
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.