CID 83763

5502-75-0

Structural Information

Molecular Formula

C₁₀H₂₀O

SMILES

CC(C)C1CCC(CC1)CO

InChI

InChI=1S/C10H20O/c1-8(2)10-5-3-9(7-11)4-6-10/h8-11H,3-7H2,1-2H3

InChIKey

KHWTYGFHPHRQMP-UHFFFAOYSA-N

Compound name

(4-propan-2-ylcyclohexyl)methanol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 10
References: 3591
Patents: 156.15141 Da
Monoisotopic Mass: 3.0
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]+	157.15869	137.2
[M+Na]+	179.14063	147.3
[M+NH4]+	174.18523	146.2
[M+K]+	195.11457	141.4
[M-H]-	155.14413	139.0
[M+Na-2H]-	177.12608	141.4
[M]+	156.15086	139.0
[M]-	156.15196	139.0

Literature stripe

literature stripe

Patent stripe

patents stripe