CID 15046

2-phenylcyclohexanol

Structural Information

Molecular Formula

C₁₂H₁₆O

SMILES

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

InChI

InChI=1S/C12H16O/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-3,6-7,11-13H,4-5,8-9H2

InChIKey

AAIBYZBZXNWTPP-UHFFFAOYSA-N

Compound name

2-phenylcyclohexan-1-ol

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 5
References: 762
Patents: 176.12012 Da
Monoisotopic Mass: 2.7
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]+	177.12740	139.8
[M+Na]+	199.10934	152.9
[M+NH4]+	194.15394	149.8
[M+K]+	215.08328	145.1
[M-H]-	175.11284	144.6
[M+Na-2H]-	197.09479	148.2
[M]+	176.11957	143.0
[M]-	176.12067	143.0

Literature stripe

literature stripe

Patent stripe

patents stripe