CID 427071

Cyclopentyl-(1-phenyl-ethyl)-amine

Structural Information

Molecular Formula
C13H19N
SMILES
CC(C1=CC=CC=C1)NC2CCCC2
InChI
InChI=1S/C13H19N/c1-11(12-7-3-2-4-8-12)14-13-9-5-6-10-13/h2-4,7-8,11,13-14H,5-6,9-10H2,1H3
InChIKey
QAWCRVLOFPHFRM-UHFFFAOYSA-N
Compound name
N-(1-phenylethyl)cyclopentanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

8
References

15
Patents

189.15175 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.159026 144.7
[M+Na]+ 212.140968 148.4
[M-H]- 188.144474 150.4
[M+NH4]+ 207.185573 165.2
[M+K]+ 228.114908 145.8
[M+H-H2O]+ 172.149010 137.7
[M+HCOO]- 234.149951 167.3
[M+CH3COO]- 248.165601 185.4
[M+Na-2H]- 210.126416 147.9
[M]+ 189.15120142 139.9
[M]- 189.15229858 139.9
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