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 148.5
[M+Na]+ 247.12057 156.5
[M-H]- 223.12407 156.8
[M+NH4]+ 242.16517 159.8
[M+K]+ 263.09451 151.7
[M+H-H2O]+ 207.12861 140.1
[M+HCOO]- 269.12955 171.7
[M+CH3COO]- 283.14520 160.3
[M+Na-2H]- 245.10602 154.4
[M]+ 224.13080 147.7
[M]- 224.13190 147.7
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.