CID 75360911

1-(5-chloropyrazin-2-yl)ethan-1-amine

Structural Information

Molecular Formula
C6H8ClN3
SMILES
CC(C1=CN=C(C=N1)Cl)N
InChI
InChI=1S/C6H8ClN3/c1-4(8)5-2-10-6(7)3-9-5/h2-4H,8H2,1H3
InChIKey
SXBSRDJNLZZIFB-UHFFFAOYSA-N
Compound name
1-(5-chloropyrazin-2-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

157.04068 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.04796 129.6
[M+Na]+ 180.02990 138.9
[M-H]- 156.03340 130.2
[M+NH4]+ 175.07450 148.3
[M+K]+ 196.00384 135.6
[M+H-H2O]+ 140.03794 123.2
[M+HCOO]- 202.03888 147.3
[M+CH3COO]- 216.05453 177.6
[M+Na-2H]- 178.01535 136.4
[M]+ 157.04013 129.3
[M]- 157.04123 129.3
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