CID 11829725

6-phenyl-2,3,4,5-tetrahydropyridine

Structural Information

Molecular Formula
C11H13N
SMILES
C1CCN=C(C1)C2=CC=CC=C2
InChI
InChI=1S/C11H13N/c1-2-6-10(7-3-1)11-8-4-5-9-12-11/h1-3,6-7H,4-5,8-9H2
InChIKey
XEJFZEYFXUTFPM-UHFFFAOYSA-N
Compound name
6-phenyl-2,3,4,5-tetrahydropyridine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

103
Patents

159.1048 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.11208 134.9
[M+Na]+ 182.09402 149.6
[M+NH4]+ 177.13862 145.2
[M+K]+ 198.06796 141.0
[M-H]- 158.09752 140.0
[M+Na-2H]- 180.07947 145.3
[M]+ 159.10425 138.6
[M]- 159.10535 138.6
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