CID 61077708

1183418-91-8

Structural Information

Molecular Formula
C14H10F2O
SMILES
C1=CC=C(C(=C1)C(=O)CC2=CC(=CC=C2)F)F
InChI
InChI=1S/C14H10F2O/c15-11-5-3-4-10(8-11)9-14(17)12-6-1-2-7-13(12)16/h1-8H,9H2
InChIKey
BXZGOYRLLHKLHG-UHFFFAOYSA-N
Compound name
1-(2-fluorophenyl)-2-(3-fluorophenyl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

232.06998 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 233.07726 147.4
[M+Na]+ 255.05920 156.0
[M-H]- 231.06270 151.7
[M+NH4]+ 250.10380 165.1
[M+K]+ 271.03314 151.6
[M+H-H2O]+ 215.06724 138.5
[M+HCOO]- 277.06818 169.0
[M+CH3COO]- 291.08383 191.8
[M+Na-2H]- 253.04465 151.6
[M]+ 232.06943 145.1
[M]- 232.07053 145.1
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.