CID 73277

2-chloropyrazine

Structural Information

Molecular Formula
C4H3ClN2
SMILES
C1=CN=C(C=N1)Cl
InChI
InChI=1S/C4H3ClN2/c5-4-3-6-1-2-7-4/h1-3H
InChIKey
GELVZYOEQVJIRR-UHFFFAOYSA-N
Compound name
2-chloropyrazine
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

16
References

7301
Patents

113.998474 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.00575 115.7
[M+Na]+ 136.98769 131.0
[M+NH4]+ 132.03230 125.3
[M+K]+ 152.96163 123.7
[M-H]- 112.99120 117.6
[M+Na-2H]- 134.97314 125.1
[M]+ 113.99793 118.7
[M]- 113.99902 118.7
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