CID 737910

1-[2-[(4-fluorophenyl)methoxy]phenyl]ethanone

Structural Information

Molecular Formula
C15H13FO2
SMILES
CC(=O)C1=CC=CC=C1OCC2=CC=C(C=C2)F
InChI
InChI=1S/C15H13FO2/c1-11(17)14-4-2-3-5-15(14)18-10-12-6-8-13(16)9-7-12/h2-9H,10H2,1H3
InChIKey
GVLDMYWQSWDCMI-UHFFFAOYSA-N
Compound name
1-[2-[(4-fluorophenyl)methoxy]phenyl]ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

244.08995 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 245.097226 152.5
[M+Na]+ 267.079168 160.5
[M-H]- 243.082674 158.1
[M+NH4]+ 262.123773 169.8
[M+K]+ 283.053108 157.0
[M+H-H2O]+ 227.087210 144.2
[M+HCOO]- 289.088151 175.1
[M+CH3COO]- 303.103801 194.0
[M+Na-2H]- 265.064616 156.8
[M]+ 244.08940142 153.1
[M]- 244.09049858 153.1
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.