CID 21785149

5-bromo-6-methylpyrazin-2-amine

Structural Information

Molecular Formula
C5H6BrN3
SMILES
CC1=NC(=CN=C1Br)N
InChI
InChI=1S/C5H6BrN3/c1-3-5(6)8-2-4(7)9-3/h2H,1H3,(H2,7,9)
InChIKey
YNMLUNRXLAUIDA-UHFFFAOYSA-N
Compound name
5-bromo-6-methylpyrazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

186.9745 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 187.98178 127.0
[M+Na]+ 209.96372 140.2
[M-H]- 185.96722 131.1
[M+NH4]+ 205.00832 147.8
[M+K]+ 225.93766 129.2
[M+H-H2O]+ 169.97176 126.2
[M+HCOO]- 231.97270 148.3
[M+CH3COO]- 245.98835 181.6
[M+Na-2H]- 207.94917 136.5
[M]+ 186.97395 144.3
[M]- 186.97505 144.3
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