CID 82806334

1-(2-fluoro-3-methoxyphenyl)ethan-1-ol

Structural Information

Molecular Formula
C9H11FO2
SMILES
CC(C1=C(C(=CC=C1)OC)F)O
InChI
InChI=1S/C9H11FO2/c1-6(11)7-4-3-5-8(12-2)9(7)10/h3-6,11H,1-2H3
InChIKey
MBOGAWLPMHUCSK-UHFFFAOYSA-N
Compound name
1-(2-fluoro-3-methoxyphenyl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
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 132.6
[M+Na]+ 193.06353 141.2
[M-H]- 169.06703 134.2
[M+NH4]+ 188.10813 152.8
[M+K]+ 209.03747 139.6
[M+H-H2O]+ 153.07157 126.6
[M+HCOO]- 215.07251 154.1
[M+CH3COO]- 229.08816 178.5
[M+Na-2H]- 191.04898 137.1
[M]+ 170.07376 132.5
[M]- 170.07486 132.5
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