CID 10535606

324020-70-4

Structural Information

Molecular Formula
C12H9FO
SMILES
CC(=O)C1=CC2=C(C=C1)C=CC(=C2)F
InChI
InChI=1S/C12H9FO/c1-8(14)10-3-2-9-4-5-12(13)7-11(9)6-10/h2-7H,1H3
InChIKey
UXFZUFVOHYDZLR-UHFFFAOYSA-N
Compound name
1-(7-fluoronaphthalen-2-yl)ethanone
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

188.06374 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 189.071016 135.9
[M+Na]+ 211.052958 145.4
[M-H]- 187.056464 139.7
[M+NH4]+ 206.097563 157.0
[M+K]+ 227.026898 142.0
[M+H-H2O]+ 171.061000 129.3
[M+HCOO]- 233.061941 157.8
[M+CH3COO]- 247.077591 184.8
[M+Na-2H]- 209.038406 142.7
[M]+ 188.06319142 135.4
[M]- 188.06428858 135.4
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