CID 139165

1-phenylcyclopentanol

Structural Information

Molecular Formula

C₁₁H₁₄O

SMILES

C1CCC(C1)(C2=CC=CC=C2)O

InChI

InChI=1S/C11H14O/c12-11(8-4-5-9-11)10-6-2-1-3-7-10/h1-3,6-7,12H,4-5,8-9H2

InChIKey

ITHZGJVAQFFNCZ-UHFFFAOYSA-N

Compound name

1-phenylcyclopentan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 79
Patents: 162.10446 Da
Monoisotopic Mass: 2.1
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]+	163.11174	136.5
[M+Na]+	185.09368	148.4
[M+NH4]+	180.13828	147.9
[M+K]+	201.06762	141.1
[M-H]-	161.09718	140.4
[M+Na-2H]-	183.07913	145.8
[M]+	162.10391	139.4
[M]-	162.10501	139.4

Literature stripe

literature stripe

Patent stripe

patents stripe