CID 12236939

2-amino-6-methylpyrazine

Structural Information

Molecular Formula
C5H7N3
SMILES
CC1=CN=CC(=N1)N
InChI
InChI=1S/C5H7N3/c1-4-2-7-3-5(6)8-4/h2-3H,1H3,(H2,6,8)
InChIKey
UAOOJJPSCLNTOP-UHFFFAOYSA-N
Compound name
6-methylpyrazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

437
Patents

109.063995 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 110.07127 119.2
[M+Na]+ 132.05321 128.5
[M-H]- 108.05672 120.2
[M+NH4]+ 127.09782 139.2
[M+K]+ 148.02715 126.9
[M+H-H2O]+ 92.061255 112.5
[M+HCOO]- 154.06220 142.9
[M+CH3COO]- 168.07785 169.8
[M+Na-2H]- 130.03866 128.3
[M]+ 109.06345 117.3
[M]- 109.06454 117.3
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

patents stripe