CID 10657884

Dodecyl(2-hydroxyethyl)methylamine

Structural Information

Molecular Formula

C₁₅H₃₃NO

SMILES

CCCCCCCCCCCCN(C)CCO

InChI

InChI=1S/C15H33NO/c1-3-4-5-6-7-8-9-10-11-12-13-16(2)14-15-17/h17H,3-15H2,1-2H3

InChIKey

JOLMGYIWICXNDT-UHFFFAOYSA-N

Compound name

2-[dodecyl(methyl)amino]ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 1
References: 301
Patents: 243.25621 Da
Monoisotopic Mass: 5.2
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]+	244.263486	167.9
[M+Na]+	266.245428	170.3
[M-H]-	242.248934	166.5
[M+NH4]+	261.290033	185.3
[M+K]+	282.219368	168.5
[M+H-H2O]+	226.253470	161.3
[M+HCOO]-	288.254411	189.0
[M+CH3COO]-	302.270061	202.0
[M+Na-2H]-	264.230876	169.0
[M]+	243.25566142	172.6
[M]-	243.25675858	172.6

Literature stripe

literature stripe

Patent stripe

patents stripe