CID 12836208

P-menth-3-enol

Structural Information

Molecular Formula

C₁₀H₁₈O

SMILES

CC1CCC(=C(C1)O)C(C)C

InChI

InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-8,11H,4-6H2,1-3H3

InChIKey

LHMGSNZLLXEMFF-UHFFFAOYSA-N

Compound name

5-methyl-2-propan-2-ylcyclohexen-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 13
Patents: 154.13577 Da
Monoisotopic Mass: 2.8
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]+	155.14305	135.0
[M+Na]+	177.12499	141.1
[M-H]-	153.12849	137.1
[M+NH4]+	172.16959	155.9
[M+K]+	193.09893	139.6
[M+H-H2O]+	137.13303	130.2
[M+HCOO]-	199.13397	154.0
[M+CH3COO]-	213.14962	177.6
[M+Na-2H]-	175.11044	137.6
[M]+	154.13522	132.1
[M]-	154.13632	132.1

Literature stripe

literature stripe

Patent stripe

patents stripe