CID 14549654

5-bromo-2,3-difluoropyridine

Structural Information

Molecular Formula
C5H2BrF2N
SMILES
C1=C(C=NC(=C1F)F)Br
InChI
InChI=1S/C5H2BrF2N/c6-3-1-4(7)5(8)9-2-3/h1-2H
InChIKey
QVIQXJRQVOPYGI-UHFFFAOYSA-N
Compound name
5-bromo-2,3-difluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

962
Patents

192.93387 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.94115 126.0
[M+Na]+ 215.92309 140.2
[M-H]- 191.92659 129.4
[M+NH4]+ 210.96769 148.3
[M+K]+ 231.89703 129.3
[M+H-H2O]+ 175.93113 125.0
[M+HCOO]- 237.93207 146.2
[M+CH3COO]- 251.94772 180.4
[M+Na-2H]- 213.90854 134.9
[M]+ 192.93332 142.3
[M]- 192.93442 142.3
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

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