CID 138039861

2241130-38-9

Structural Information

Molecular Formula
C15H16N2
SMILES
C1C(C1C(C2=CC=CC=C2)N)C3=CC=NC=C3
InChI
InChI=1S/C15H16N2/c16-15(12-4-2-1-3-5-12)14-10-13(14)11-6-8-17-9-7-11/h1-9,13-15H,10,16H2
InChIKey
JRQLDZRQWHDHMM-UHFFFAOYSA-N
Compound name
phenyl-(2-pyridin-4-ylcyclopropyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

224.13135 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 225.13863 153.9
[M+Na]+ 247.12057 169.4
[M+NH4]+ 242.16517 163.7
[M+K]+ 263.09451 162.8
[M-H]- 223.12407 166.9
[M+Na-2H]- 245.10602 166.7
[M]+ 224.13080 161.0
[M]- 224.13190 161.0
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.