CID 131173728

2-fluoro-4-iodopyrimidine

Structural Information

Molecular Formula
C4H2FIN2
SMILES
C1=CN=C(N=C1I)F
InChI
InChI=1S/C4H2FIN2/c5-4-7-2-1-3(6)8-4/h1-2H
InChIKey
YQUXLKLFXILYLQ-UHFFFAOYSA-N
Compound name
2-fluoro-4-iodopyrimidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

223.92467 Da
Monoisotopic Mass

1.3
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

No literature data available for this compound.

Patent stripe

No patent data available for this compound.