CID 54594634

(1s)-1-(4-fluoro-2-methoxyphenyl)ethan-1-ol

Structural Information

Molecular Formula
C9H11FO2
SMILES
C[C@@H](C1=C(C=C(C=C1)F)OC)O
InChI
InChI=1S/C9H11FO2/c1-6(11)8-4-3-7(10)5-9(8)12-2/h3-6,11H,1-2H3/t6-/m0/s1
InChIKey
AQZVUWCKRCLTJL-LURJTMIESA-N
Compound name
(1S)-1-(4-fluoro-2-methoxyphenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

170.07431 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.08159 134.9
[M+Na]+ 193.06353 146.8
[M+NH4]+ 188.10813 142.6
[M+K]+ 209.03747 141.2
[M-H]- 169.06703 135.1
[M+Na-2H]- 191.04898 140.5
[M]+ 170.07376 136.5
[M]- 170.07486 136.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe