CID 22046323

13535-07-4

Structural Information

Molecular Formula
C6H9N3
SMILES
CCC1=CN=C(C=N1)N
InChI
InChI=1S/C6H9N3/c1-2-5-3-9-6(7)4-8-5/h3-4H,2H2,1H3,(H2,7,9)
InChIKey
ITXMRWYSIZIJDG-UHFFFAOYSA-N
Compound name
5-ethylpyrazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

141
Patents

123.07965 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.086926 123.7
[M+Na]+ 146.068868 132.7
[M-H]- 122.072374 124.6
[M+NH4]+ 141.113473 143.2
[M+K]+ 162.042808 130.8
[M+H-H2O]+ 106.076910 116.8
[M+HCOO]- 168.077851 147.1
[M+CH3COO]- 182.093501 172.8
[M+Na-2H]- 144.054316 132.3
[M]+ 123.07910142 122.3
[M]- 123.08019858 122.3
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