CID 46835711

5-ethynyl-2-fluoropyridine

Structural Information

Molecular Formula
C7H4FN
SMILES
C#CC1=CN=C(C=C1)F
InChI
InChI=1S/C7H4FN/c1-2-6-3-4-7(8)9-5-6/h1,3-5H
InChIKey
VOBVNAROKVDQSV-UHFFFAOYSA-N
Compound name
5-ethynyl-2-fluoropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

49
Patents

121.032776 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.04005 123.9
[M+Na]+ 144.02199 137.4
[M+NH4]+ 139.06660 129.0
[M+K]+ 159.99593 127.3
[M-H]- 120.02550 116.7
[M+Na-2H]- 142.00744 128.6
[M]+ 121.03223 123.0
[M]- 121.03332 123.0
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