CID 602279

1-propanol, 2,2-diphenyl-

Structural Information

Molecular Formula

C₁₅H₁₆O

SMILES

CC(CO)(C1=CC=CC=C1)C2=CC=CC=C2

InChI

InChI=1S/C15H16O/c1-15(12-16,13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,16H,12H2,1H3

InChIKey

WAUNMVYXQAKNLE-UHFFFAOYSA-N

Compound name

2,2-diphenylpropan-1-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 101
Patents: 212.12012 Da
Monoisotopic Mass: 3.5
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]+	213.127396	148.2
[M+Na]+	235.109338	154.5
[M-H]-	211.112844	153.3
[M+NH4]+	230.153943	165.9
[M+K]+	251.083278	150.4
[M+H-H2O]+	195.117380	141.6
[M+HCOO]-	257.118321	169.4
[M+CH3COO]-	271.133971	184.9
[M+Na-2H]-	233.094786	156.0
[M]+	212.11957142	146.7
[M]-	212.12066858	146.7

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe