CID 201828

Benzhydrol, alpha-(aminomethyl)-, hydrochloride

Structural Information

Molecular Formula

C₁₄H₁₅NO

SMILES

C1=CC=C(C=C1)C(CN)(C2=CC=CC=C2)O

InChI

InChI=1S/C14H15NO/c15-11-14(16,12-7-3-1-4-8-12)13-9-5-2-6-10-13/h1-10,16H,11,15H2

InChIKey

QFWZRNZLPMDFNA-UHFFFAOYSA-N

Compound name

2-amino-1,1-diphenylethanol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 2
References: 88
Patents: 213.11537 Da
Monoisotopic Mass: 1.6
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	149.3
[M+Na]+	236.10459	162.4
[M+NH4]+	231.14919	158.2
[M+K]+	252.07853	155.3
[M-H]-	212.10809	153.9
[M+Na-2H]-	234.09004	159.2
[M]+	213.11482	152.6
[M]-	213.11592	152.6

Literature stripe

literature stripe

Patent stripe

patents stripe