CID 80586

2-diphenylaminoethanol

Structural Information

Molecular Formula

C₁₄H₁₅NO

SMILES

C1=CC=C(C=C1)N(CCO)C2=CC=CC=C2

InChI

InChI=1S/C14H15NO/c16-12-11-15(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,16H,11-12H2

InChIKey

CMQZETQFZHIYJG-UHFFFAOYSA-N

Compound name

2-(N-phenylanilino)ethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 251
Patents: 213.11537 Da
Monoisotopic Mass: 3.2
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]+	214.12265	147.3
[M+Na]+	236.10459	152.7
[M-H]-	212.10809	153.6
[M+NH4]+	231.14919	165.0
[M+K]+	252.07853	149.7
[M+H-H2O]+	196.11263	139.6
[M+HCOO]-	258.11357	171.9
[M+CH3COO]-	272.12922	189.8
[M+Na-2H]-	234.09004	154.6
[M]+	213.11482	146.4
[M]-	213.11592	146.4

Literature stripe

literature stripe

Patent stripe

patents stripe