CID 11790156

21983-80-2

Structural Information

Molecular Formula
C10H11FO3
SMILES
COC(C(=O)C1=CC=C(C=C1)F)OC
InChI
InChI=1S/C10H11FO3/c1-13-10(14-2)9(12)7-3-5-8(11)6-4-7/h3-6,10H,1-2H3
InChIKey
WOWWVWLWNMOMHX-UHFFFAOYSA-N
Compound name
1-(4-fluorophenyl)-2,2-dimethoxyethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

198.06923 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 199.07651 139.2
[M+Na]+ 221.05845 146.8
[M-H]- 197.06195 141.7
[M+NH4]+ 216.10305 158.4
[M+K]+ 237.03239 146.2
[M+H-H2O]+ 181.06649 132.4
[M+HCOO]- 243.06743 161.3
[M+CH3COO]- 257.08308 185.1
[M+Na-2H]- 219.04390 143.1
[M]+ 198.06868 141.1
[M]- 198.06978 141.1
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.