CID 96723

28005-74-5

Structural Information

Molecular Formula

C₁₁H₁₇NO₂

SMILES

CC1=CC=CC=C1N(CCO)CCO

InChI

InChI=1S/C11H17NO2/c1-10-4-2-3-5-11(10)12(6-8-13)7-9-14/h2-5,13-14H,6-9H2,1H3

InChIKey

LWAFETVQZHKDIS-UHFFFAOYSA-N

Compound name

2-[N-(2-hydroxyethyl)-2-methylanilino]ethanol

Related CIDs

2D Structure

compound 2d structure

3
Annotation Hits: 0
References: 1663
Patents: 195.12593 Da
Monoisotopic Mass: 1.5
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]+	196.13321	144.2
[M+Na]+	218.11515	155.0
[M+NH4]+	213.15975	152.0
[M+K]+	234.08909	149.2
[M-H]-	194.11865	146.1
[M+Na-2H]-	216.10060	150.0
[M]+	195.12538	146.1
[M]-	195.12648	146.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe