CID 17395793

Akos034442775

Structural Information

Molecular Formula
C13H16N2O
SMILES
C1CN(CC=C1C2=CC=CC=C2)CC(=O)N
InChI
InChI=1S/C13H16N2O/c14-13(16)10-15-8-6-12(7-9-15)11-4-2-1-3-5-11/h1-6H,7-10H2,(H2,14,16)
InChIKey
AFLLVHVIFBZUPS-UHFFFAOYSA-N
Compound name
2-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)acetamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

216.12627 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.13355 150.0
[M+Na]+ 239.11549 162.2
[M+NH4]+ 234.16009 158.3
[M+K]+ 255.08943 155.3
[M-H]- 215.11899 154.1
[M+Na-2H]- 237.10094 157.8
[M]+ 216.12572 152.7
[M]- 216.12682 152.7
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

No patent data available for this compound.