CID 13493844

96826-25-4

Structural Information

Molecular Formula

C₁₀H₁₃FO₂

SMILES

CC(C)(C1=C(C=C(C=C1)OC)F)O

InChI

InChI=1S/C10H13FO2/c1-10(2,12)8-5-4-7(13-3)6-9(8)11/h4-6,12H,1-3H3

InChIKey

RNCUHIILUNOEGW-UHFFFAOYSA-N

Compound name

2-(2-fluoro-4-methoxyphenyl)propan-2-ol

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 75
Patents: 184.08995 Da
Monoisotopic Mass: 1.7
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]+	185.09723	137.1
[M+Na]+	207.07917	146.0
[M-H]-	183.08267	138.7
[M+NH4]+	202.12377	156.9
[M+K]+	223.05311	144.0
[M+H-H2O]+	167.08721	131.5
[M+HCOO]-	229.08815	157.7
[M+CH3COO]-	243.10380	181.1
[M+Na-2H]-	205.06462	143.1
[M]+	184.08940	137.5
[M]-	184.09050	137.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe