CID 51072307

3-chloro-n-methylpyrazin-2-amine

Structural Information

Molecular Formula
C5H6ClN3
SMILES
CNC1=NC=CN=C1Cl
InChI
InChI=1S/C5H6ClN3/c1-7-5-4(6)8-2-3-9-5/h2-3H,1H3,(H,7,9)
InChIKey
CLVOWQGBRGLTBC-UHFFFAOYSA-N
Compound name
3-chloro-N-methylpyrazin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

107
Patents

143.02502 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 144.032296 124.4
[M+Na]+ 166.014238 134.4
[M-H]- 142.017744 125.5
[M+NH4]+ 161.058843 144.0
[M+K]+ 181.988178 131.2
[M+H-H2O]+ 126.022280 118.1
[M+HCOO]- 188.023221 144.0
[M+CH3COO]- 202.038871 174.4
[M+Na-2H]- 163.999686 134.0
[M]+ 143.02447142 125.3
[M]- 143.02556858 125.3
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