CID 59385156

2-amino-1-(pyrazin-2-yl)ethan-1-one dihydrochloride

Structural Information

Molecular Formula
C6H7N3O
SMILES
C1=CN=C(C=N1)C(=O)CN
InChI
InChI=1S/C6H7N3O/c7-3-6(10)5-4-8-1-2-9-5/h1-2,4H,3,7H2
InChIKey
SNRBZNXCGPUZNH-UHFFFAOYSA-N
Compound name
2-amino-1-pyrazin-2-ylethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

137.05891 Da
Monoisotopic Mass

-0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.06619 126.0
[M+Na]+ 160.04813 137.7
[M+NH4]+ 155.09273 133.4
[M+K]+ 176.02207 132.7
[M-H]- 136.05163 126.8
[M+Na-2H]- 158.03358 132.9
[M]+ 137.05836 127.6
[M]- 137.05946 127.6
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