CID 598734

2-amino-5-phenylpyrazine

Structural Information

Molecular Formula
C10H9N3
SMILES
C1=CC=C(C=C1)C2=CN=C(C=N2)N
InChI
InChI=1S/C10H9N3/c11-10-7-12-9(6-13-10)8-4-2-1-3-5-8/h1-7H,(H2,11,13)
InChIKey
KJAKXVBZQBPPOB-UHFFFAOYSA-N
Compound name
5-phenylpyrazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

161
Patents

171.07965 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 172.08693 135.2
[M+Na]+ 194.06887 150.4
[M+NH4]+ 189.11347 144.2
[M+K]+ 210.04281 142.9
[M-H]- 170.07237 139.9
[M+Na-2H]- 192.05432 146.2
[M]+ 171.07910 138.7
[M]- 171.08020 138.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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