CID 105434414

2-(4-fluorophenyl)-2-methoxyethan-1-ol

Structural Information

Molecular Formula
C9H11FO2
SMILES
COC(CO)C1=CC=C(C=C1)F
InChI
InChI=1S/C9H11FO2/c1-12-9(6-11)7-2-4-8(10)5-3-7/h2-5,9,11H,6H2,1H3
InChIKey
ZYRUZABXGYQLBP-UHFFFAOYSA-N
Compound name
2-(4-fluorophenyl)-2-methoxyethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

170.07431 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 171.081586 133.3
[M+Na]+ 193.063528 141.0
[M-H]- 169.067034 134.5
[M+NH4]+ 188.108133 153.2
[M+K]+ 209.037468 139.3
[M+H-H2O]+ 153.071570 127.1
[M+HCOO]- 215.072511 154.8
[M+CH3COO]- 229.088161 177.4
[M+Na-2H]- 191.048976 138.6
[M]+ 170.07376142 132.9
[M]- 170.07485858 132.9
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

No patent data available for this compound.