CID 20567072

5-[3-(trifluoromethyl)phenyl]pyrazin-2-amine hydrochloride

Structural Information

Molecular Formula
C11H8F3N3
SMILES
C1=CC(=CC(=C1)C(F)(F)F)C2=CN=C(C=N2)N
InChI
InChI=1S/C11H8F3N3/c12-11(13,14)8-3-1-2-7(4-8)9-5-17-10(15)6-16-9/h1-6H,(H2,15,17)
InChIKey
KYZMABUPSVQWFX-UHFFFAOYSA-N
Compound name
5-[3-(trifluoromethyl)phenyl]pyrazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

20
Patents

239.06703 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 240.07431 150.3
[M+Na]+ 262.05625 161.2
[M+NH4]+ 257.10085 155.8
[M+K]+ 278.03019 155.6
[M-H]- 238.05975 149.3
[M+Na-2H]- 260.04170 157.4
[M]+ 239.06648 151.3
[M]- 239.06758 151.3
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