CID 97466

5,8-dihydro-1-naphthol

Structural Information

Molecular Formula

C₁₀H₁₀O

SMILES

C1C=CCC2=C1C=CC=C2O

InChI

InChI=1S/C10H10O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-3,5,7,11H,4,6H2

InChIKey

OAHLLHJOPUWLKW-UHFFFAOYSA-N

Compound name

5,8-dihydronaphthalen-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 144
Patents: 146.07317 Da
Monoisotopic Mass: 2.7
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]+	147.08045	126.9
[M+Na]+	169.06239	134.9
[M-H]-	145.06589	130.3
[M+NH4]+	164.10699	148.9
[M+K]+	185.03633	131.8
[M+H-H2O]+	129.07043	121.8
[M+HCOO]-	191.07137	148.5
[M+CH3COO]-	205.08702	140.8
[M+Na-2H]-	167.04784	135.9
[M]+	146.07262	124.6
[M]-	146.07372	124.6

Literature stripe

literature stripe

Patent stripe

patents stripe