CID 60623020

4-(difluoromethyl)-3-fluoropyridine

Structural Information

Molecular Formula
C6H4F3N
SMILES
C1=CN=CC(=C1C(F)F)F
InChI
InChI=1S/C6H4F3N/c7-5-3-10-2-1-4(5)6(8)9/h1-3,6H
InChIKey
YKZXXQAANXDBTG-UHFFFAOYSA-N
Compound name
4-(difluoromethyl)-3-fluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

147.02959 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 148.03687 129.8
[M+Na]+ 170.01881 140.3
[M+NH4]+ 165.06341 136.4
[M+K]+ 185.99275 134.6
[M-H]- 146.02231 127.4
[M+Na-2H]- 168.00426 135.3
[M]+ 147.02904 130.3
[M]- 147.03014 130.3
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

patents stripe