CID 137749

2,3,5,6-tetrafluoropyridine

Structural Information

Molecular Formula
C5HF4N
SMILES
C1=C(C(=NC(=C1F)F)F)F
InChI
InChI=1S/C5HF4N/c6-2-1-3(7)5(9)10-4(2)8/h1H
InChIKey
HWIPMBCMGVXOKN-UHFFFAOYSA-N
Compound name
2,3,5,6-tetrafluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

6
References

1158
Patents

151.00452 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.01180 118.7
[M+Na]+ 173.99374 130.8
[M-H]- 149.99724 116.9
[M+NH4]+ 169.03834 139.2
[M+K]+ 189.96768 128.2
[M+H-H2O]+ 134.00178 109.8
[M+HCOO]- 196.00272 139.0
[M+CH3COO]- 210.01837 176.5
[M+Na-2H]- 171.97919 124.8
[M]+ 151.00397 114.1
[M]- 151.00507 114.1
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