CID 84823

15182-92-0

Structural Information

Molecular Formula

C₁₁H₁₅NO₂

SMILES

CN(C)CCOC1=CC=C(C=C1)C=O

InChI

InChI=1S/C11H15NO2/c1-12(2)7-8-14-11-5-3-10(9-13)4-6-11/h3-6,9H,7-8H2,1-2H3

InChIKey

CBOKAZFQZOQTOC-UHFFFAOYSA-N

Compound name

4-[2-(dimethylamino)ethoxy]benzaldehyde

Related CIDs

2D Structure

compound 2d structure

2
Annotation Hits: 0
References: 298
Patents: 193.11028 Da
Monoisotopic Mass: 1.4
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]+	194.117556	141.8
[M+Na]+	216.099498	148.8
[M-H]-	192.103004	146.8
[M+NH4]+	211.144103	161.8
[M+K]+	232.073438	148.2
[M+H-H2O]+	176.107540	135.2
[M+HCOO]-	238.108481	167.9
[M+CH3COO]-	252.124131	190.0
[M+Na-2H]-	214.084946	147.8
[M]+	193.10973142	145.6
[M]-	193.11082858	145.6

Literature stripe

literature stripe

Patent stripe

patents stripe