CID 11230

Terpinen-4-ol

Structural Information

Molecular Formula

C₁₀H₁₈O

SMILES

CC1=CCC(CC1)(C(C)C)O

InChI

InChI=1S/C10H18O/c1-8(2)10(11)6-4-9(3)5-7-10/h4,8,11H,5-7H2,1-3H3

InChIKey

WRYLYDPHFGVWKC-UHFFFAOYSA-N

Compound name

4-methyl-1-propan-2-ylcyclohex-3-en-1-ol

Related CIDs

2D Structure

compound 2d structure

8
Annotation Hits: 346
References: 12623
Patents: 154.13577 Da
Monoisotopic Mass: 2.2
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	135.5
[M+Na]+	177.12499	146.7
[M+NH4]+	172.16959	146.0
[M+K]+	193.09893	138.9
[M-H]-	153.12849	137.5
[M+Na-2H]-	175.11044	142.2
[M]+	154.13522	137.8
[M]-	154.13632	137.8

Literature stripe

literature stripe

Patent stripe

patents stripe