CID 167651

17380-74-4

Structural Information

Molecular Formula

C₁₁H₁₅N

SMILES

C1CCC(C1)(C2=CC=CC=C2)N

InChI

InChI=1S/C11H15N/c12-11(8-4-5-9-11)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,12H2

InChIKey

YXAQCAOJLDGGDZ-UHFFFAOYSA-N

Compound name

1-phenylcyclopentan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 5
References: 253
Patents: 161.12045 Da
Monoisotopic Mass: 1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	162.127726	135.4
[M+Na]+	184.109668	141.3
[M-H]-	160.113174	141.3
[M+NH4]+	179.154273	158.9
[M+K]+	200.083608	138.4
[M+H-H2O]+	144.117710	129.4
[M+HCOO]-	206.118651	159.2
[M+CH3COO]-	220.134301	148.7
[M+Na-2H]-	182.095116	140.9
[M]+	161.11990142	129.9
[M]-	161.12099858	129.9

Literature stripe

literature stripe

Patent stripe

patents stripe