CID 4434155

61982-91-0

Structural Information

Molecular Formula

C₁₁H₁₄O₂

SMILES

COC1=CC=CC2=C1CCCC2O

InChI

InChI=1S/C11H14O2/c1-13-11-7-3-4-8-9(11)5-2-6-10(8)12/h3-4,7,10,12H,2,5-6H2,1H3

InChIKey

KEHUANDJKBFXBA-UHFFFAOYSA-N

Compound name

5-methoxy-1,2,3,4-tetrahydronaphthalen-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 31
Patents: 178.09938 Da
Monoisotopic Mass: 1.8
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]+	179.10666	136.6
[M+Na]+	201.08860	149.7
[M+NH4]+	196.13320	146.4
[M+K]+	217.06254	142.7
[M-H]-	177.09210	139.5
[M+Na-2H]-	199.07405	142.8
[M]+	178.09883	139.3
[M]-	178.09993	139.3

Literature stripe

literature stripe

Patent stripe

patents stripe