CID 63080601

1-(1-phenylcyclopentyl)ethan-1-amine hydrochloride

Structural Information

Molecular Formula
C13H19N
SMILES
CC(C1(CCCC1)C2=CC=CC=C2)N
InChI
InChI=1S/C13H19N/c1-11(14)13(9-5-6-10-13)12-7-3-2-4-8-12/h2-4,7-8,11H,5-6,9-10,14H2,1H3
InChIKey
ABRFXTMQISKRJO-UHFFFAOYSA-N
Compound name
1-(1-phenylcyclopentyl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.15175 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.15903 145.3
[M+Na]+ 212.14097 150.1
[M-H]- 188.14447 150.9
[M+NH4]+ 207.18557 167.6
[M+K]+ 228.11491 147.2
[M+H-H2O]+ 172.14901 139.0
[M+HCOO]- 234.14995 167.4
[M+CH3COO]- 248.16560 184.2
[M+Na-2H]- 210.12642 148.5
[M]+ 189.15120 139.8
[M]- 189.15230 139.8
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.