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

7
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 143.8
[M+Na]+ 212.14097 147.8
[M-H]- 188.14447 149.4
[M+NH4]+ 207.18557 164.3
[M+K]+ 228.11491 144.6
[M+H-H2O]+ 172.14901 136.7
[M+HCOO]- 234.14995 167.4
[M+CH3COO]- 248.16560 184.6
[M+Na-2H]- 210.12642 148.2
[M]+ 189.15120 139.6
[M]- 189.15230 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