CID 3015545

Octyl-2-naphthol

Structural Information

Molecular Formula

C₁₈H₂₄O

SMILES

CCCCCCCCC1=C(C=CC2=CC=CC=C21)O

InChI

InChI=1S/C18H24O/c1-2-3-4-5-6-7-12-17-16-11-9-8-10-15(16)13-14-18(17)19/h8-11,13-14,19H,2-7,12H2,1H3

InChIKey

AAZCPESOYPGWEG-UHFFFAOYSA-N

Compound name

1-octylnaphthalen-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 6
Patents: 256.1827 Da
Monoisotopic Mass: 6.9
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]+	257.18998	162.7
[M+Na]+	279.17192	176.7
[M+NH4]+	274.21652	172.0
[M+K]+	295.14586	167.1
[M-H]-	255.17542	166.2
[M+Na-2H]-	277.15737	169.3
[M]+	256.18215	165.9
[M]-	256.18325	165.9

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe