CID 11252188

8-fluoro-1-tetralone

Structural Information

Molecular Formula
C10H9FO
SMILES
C1CC2=C(C(=O)C1)C(=CC=C2)F
InChI
InChI=1S/C10H9FO/c11-8-5-1-3-7-4-2-6-9(12)10(7)8/h1,3,5H,2,4,6H2
InChIKey
RYMWBQHSBRCBQV-UHFFFAOYSA-N
Compound name
8-fluoro-3,4-dihydro-2H-naphthalen-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

73
Patents

164.06374 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 165.07102 132.4
[M+Na]+ 187.05296 145.7
[M+NH4]+ 182.09756 142.1
[M+K]+ 203.02690 138.1
[M-H]- 163.05646 134.5
[M+Na-2H]- 185.03841 138.9
[M]+ 164.06319 134.8
[M]- 164.06429 134.8
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