CID 4848754

N-(2-phenylethyl)cyclopentanamine hydrochloride

Structural Information

Molecular Formula
C13H19N
SMILES
C1CCC(C1)NCCC2=CC=CC=C2
InChI
InChI=1S/C13H19N/c1-2-6-12(7-3-1)10-11-14-13-8-4-5-9-13/h1-3,6-7,13-14H,4-5,8-11H2
InChIKey
FGHWNDVNDXTOLR-UHFFFAOYSA-N
Compound name
N-(2-phenylethyl)cyclopentanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

9
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 143.8
[M+Na]+ 212.140968 147.8
[M-H]- 188.144474 149.4
[M+NH4]+ 207.185573 164.3
[M+K]+ 228.114908 144.6
[M+H-H2O]+ 172.149010 136.7
[M+HCOO]- 234.149951 167.4
[M+CH3COO]- 248.165601 184.6
[M+Na-2H]- 210.126416 148.2
[M]+ 189.15120142 139.6
[M]- 189.15229858 139.6
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

patents stripe