CID 12259715

23023-17-8

Structural Information

Molecular Formula

C₁₂H₁₉NO₂

SMILES

CC(C)(CN)C1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C12H19NO2/c1-12(2,8-13)9-5-6-10(14-3)11(7-9)15-4/h5-7H,8,13H2,1-4H3

InChIKey

CYRFLEMTQNARBO-UHFFFAOYSA-N

Compound name

2-(3,4-dimethoxyphenyl)-2-methylpropan-1-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 36
Patents: 209.14159 Da
Monoisotopic Mass: 1.7
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]+	210.14887	148.0
[M+Na]+	232.13081	159.3
[M+NH4]+	227.17541	155.7
[M+K]+	248.10475	153.8
[M-H]-	208.13431	149.8
[M+Na-2H]-	230.11626	153.8
[M]+	209.14104	150.1
[M]-	209.14214	150.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe