CID 75383

2359-51-5

Structural Information

Molecular Formula

C₁₁H₁₈N₂O

SMILES

CCN(CCO)C1=CC(=C(C=C1)N)C

InChI

InChI=1S/C11H18N2O/c1-3-13(6-7-14)10-4-5-11(12)9(2)8-10/h4-5,8,14H,3,6-7,12H2,1-2H3

InChIKey

QTLHLXYADXCVCF-UHFFFAOYSA-N

Compound name

2-(4-amino-N-ethyl-3-methylanilino)ethanol

Related CIDs

2D Structure

compound 2d structure

4
Annotation Hits: 11
References: 7837
Patents: 194.1419 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]+	195.14918	144.8
[M+Na]+	217.13112	155.4
[M+NH4]+	212.17572	152.8
[M+K]+	233.10506	149.6
[M-H]-	193.13462	147.8
[M+Na-2H]-	215.11657	150.6
[M]+	194.14135	146.9
[M]-	194.14245	146.9

Literature stripe

literature stripe

Patent stripe

patents stripe