CID 4059886

2-methoxy-1,1,2-triphenyl-propan-1-ol

Structural Information

Molecular Formula

C₂₂H₂₂O₂

SMILES

CC(C1=CC=CC=C1)(C(C2=CC=CC=C2)(C3=CC=CC=C3)O)OC

InChI

InChI=1S/C22H22O2/c1-21(24-2,18-12-6-3-7-13-18)22(23,19-14-8-4-9-15-19)20-16-10-5-11-17-20/h3-17,23H,1-2H3

InChIKey

XEYOACHKIZTLLB-UHFFFAOYSA-N

Compound name

2-methoxy-1,1,2-triphenylpropan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 318.162 Da
Monoisotopic Mass: 4.1
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]+	319.169276	177.0
[M+Na]+	341.151218	181.7
[M-H]-	317.154724	184.7
[M+NH4]+	336.195823	189.6
[M+K]+	357.125158	176.7
[M+H-H2O]+	301.159260	168.4
[M+HCOO]-	363.160201	195.6
[M+CH3COO]-	377.175851	204.4
[M+Na-2H]-	339.136666	184.3
[M]+	318.16145142	176.0
[M]-	318.16254858	176.0

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe