CID 54593212

3-phenyl-2-(pyridin-2-yl)propan-1-amine

Structural Information

Molecular Formula
C14H16N2
SMILES
C1=CC=C(C=C1)CC(CN)C2=CC=CC=N2
InChI
InChI=1S/C14H16N2/c15-11-13(14-8-4-5-9-16-14)10-12-6-2-1-3-7-12/h1-9,13H,10-11,15H2
InChIKey
JLFXXFICMQGLRU-UHFFFAOYSA-N
Compound name
3-phenyl-2-pyridin-2-ylpropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

212.13135 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 213.13863 148.7
[M+Na]+ 235.12057 154.2
[M-H]- 211.12407 152.9
[M+NH4]+ 230.16517 164.9
[M+K]+ 251.09451 150.0
[M+H-H2O]+ 195.12861 140.2
[M+HCOO]- 257.12955 171.2
[M+CH3COO]- 271.14520 189.7
[M+Na-2H]- 233.10602 155.1
[M]+ 212.13080 145.9
[M]- 212.13190 145.9
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.