CID 89437

Cyclohexanol, 1-methyl-4-(1-methylethyl)-

Structural Information

Molecular Formula

C₁₀H₂₀O

SMILES

CC(C)C1CCC(CC1)(C)O

InChI

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

InChIKey

CMLYGGFIXXLYQT-UHFFFAOYSA-N

Compound name

1-methyl-4-propan-2-ylcyclohexan-1-ol

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 1
References: 647
Patents: 156.15141 Da
Monoisotopic Mass: 2.6
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	137.4
[M+Na]+	179.14063	147.6
[M+NH4]+	174.18523	147.8
[M+K]+	195.11457	140.0
[M-H]-	155.14413	139.1
[M+Na-2H]-	177.12608	143.1
[M]+	156.15086	139.4
[M]-	156.15196	139.4

Literature stripe

literature stripe

Patent stripe

patents stripe