CID 3060495

(e)-3-((furan-2-ylmethylene)amino)-2-methyl-1,1-diphenylpropan-1-ol

Structural Information

Molecular Formula

C₂₁H₂₁NO₂

SMILES

CC(CN=CC1=CC=CO1)C(C2=CC=CC=C2)(C3=CC=CC=C3)O

InChI

InChI=1S/C21H21NO2/c1-17(15-22-16-20-13-8-14-24-20)21(23,18-9-4-2-5-10-18)19-11-6-3-7-12-19/h2-14,16-17,23H,15H2,1H3

InChIKey

PLDZGJXWHJQSAN-UHFFFAOYSA-N

Compound name

3-(furan-2-ylmethylideneamino)-2-methyl-1,1-diphenylpropan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 319.15723 Da
Monoisotopic Mass: 4.0
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]+	320.164506	177.1
[M+Na]+	342.146448	181.5
[M-H]-	318.149954	186.9
[M+NH4]+	337.191053	190.6
[M+K]+	358.120388	178.0
[M+H-H2O]+	302.154490	168.7
[M+HCOO]-	364.155431	199.4
[M+CH3COO]-	378.171081	207.5
[M+Na-2H]-	340.131896	182.0
[M]+	319.15668142	177.6
[M]-	319.15777858	177.6

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.