CID 131389113

(2e)-3-(5-fluoropyridin-2-yl)prop-2-en-1-amine dihydrochloride

Structural Information

Molecular Formula
C8H9FN2
SMILES
C1=CC(=NC=C1F)/C=C/CN
InChI
InChI=1S/C8H9FN2/c9-7-3-4-8(11-6-7)2-1-5-10/h1-4,6H,5,10H2/b2-1+
InChIKey
HTEPEAFOVMPLKJ-OWOJBTEDSA-N
Compound name
(E)-3-(5-fluoro-2-pyridinyl)prop-2-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

152.07498 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 153.082256 129.5
[M+Na]+ 175.064198 137.9
[M-H]- 151.067704 130.1
[M+NH4]+ 170.108803 149.0
[M+K]+ 191.038138 134.7
[M+H-H2O]+ 135.072240 122.2
[M+HCOO]- 197.073181 152.7
[M+CH3COO]- 211.088831 177.3
[M+Na-2H]- 173.049646 136.3
[M]+ 152.07443142 126.3
[M]- 152.07552858 126.3
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

No patent data available for this compound.