CID 15047262

4-(2-fluorophenyl)-1,2,3,6-tetrahydropyridine

Structural Information

Molecular Formula
C11H12FN
SMILES
C1CNCC=C1C2=CC=CC=C2F
InChI
InChI=1S/C11H12FN/c12-11-4-2-1-3-10(11)9-5-7-13-8-6-9/h1-5,13H,6-8H2
InChIKey
HIZOTHLNNPXFHY-UHFFFAOYSA-N
Compound name
4-(2-fluorophenyl)-1,2,3,6-tetrahydropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

77
Patents

177.09538 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 178.10266 136.6
[M+Na]+ 200.08460 143.1
[M-H]- 176.08810 138.8
[M+NH4]+ 195.12920 154.4
[M+K]+ 216.05854 138.8
[M+H-H2O]+ 160.09264 128.5
[M+HCOO]- 222.09358 155.3
[M+CH3COO]- 236.10923 148.5
[M+Na-2H]- 198.07005 142.7
[M]+ 177.09483 129.7
[M]- 177.09593 129.7
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