CID 73470

63980-55-2

Structural Information

Molecular Formula

C₁₆H₁₇NO₂

SMILES

CN(C)CC(C1=CC2=C(C=C1)OC3=CC=CC=C32)O

InChI

InChI=1S/C16H17NO2/c1-17(2)10-14(18)11-7-8-16-13(9-11)12-5-3-4-6-15(12)19-16/h3-9,14,18H,10H2,1-2H3

InChIKey

WBDAUDFPTHOOIE-UHFFFAOYSA-N

Compound name

1-dibenzofuran-2-yl-2-(dimethylamino)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 0
Patents: 255.12593 Da
Monoisotopic Mass: 3.3
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]+	256.133206	157.8
[M+Na]+	278.115148	166.3
[M-H]-	254.118654	164.5
[M+NH4]+	273.159753	177.3
[M+K]+	294.089088	164.1
[M+H-H2O]+	238.123190	151.5
[M+HCOO]-	300.124131	180.4
[M+CH3COO]-	314.139781	171.0
[M+Na-2H]-	276.100596	164.1
[M]+	255.12538142	162.2
[M]-	255.12647858	162.2

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.