CID 12336391

5-fluoronaphthalen-1-ol

Structural Information

Molecular Formula
C10H7FO
SMILES
C1=CC2=C(C=CC=C2F)C(=C1)O
InChI
InChI=1S/C10H7FO/c11-9-5-1-4-8-7(9)3-2-6-10(8)12/h1-6,12H
InChIKey
KMQITEWKYHQQHH-UHFFFAOYSA-N
Compound name
5-fluoronaphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

46
Patents

162.0481 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 163.05538 128.0
[M+Na]+ 185.03732 138.0
[M-H]- 161.04082 130.7
[M+NH4]+ 180.08192 149.6
[M+K]+ 201.01126 134.3
[M+H-H2O]+ 145.04536 122.0
[M+HCOO]- 207.04630 149.9
[M+CH3COO]- 221.06195 176.1
[M+Na-2H]- 183.02277 136.7
[M]+ 162.04755 126.3
[M]- 162.04865 126.3
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe