CID 15369693

2-fluoro-3-iodopyrazine

Structural Information

Molecular Formula
C4H2FIN2
SMILES
C1=CN=C(C(=N1)F)I
InChI
InChI=1S/C4H2FIN2/c5-3-4(6)8-2-1-7-3/h1-2H
InChIKey
ZGDOFCZYQIJHRG-UHFFFAOYSA-N
Compound name
2-fluoro-3-iodopyrazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

39
Patents

223.92467 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 224.93195 120.4
[M+Na]+ 246.91389 123.6
[M-H]- 222.91739 113.7
[M+NH4]+ 241.95849 135.6
[M+K]+ 262.88783 127.9
[M+H-H2O]+ 206.92193 109.7
[M+HCOO]- 268.92287 137.8
[M+CH3COO]- 282.93852 177.6
[M+Na-2H]- 244.89934 118.0
[M]+ 223.92412 116.6
[M]- 223.92522 116.6
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