CID 54187840

3-fluoronaphthalen-1-ol

Structural Information

Molecular Formula
C10H7FO
SMILES
C1=CC=C2C(=C1)C=C(C=C2O)F
InChI
InChI=1S/C10H7FO/c11-8-5-7-3-1-2-4-9(7)10(12)6-8/h1-6,12H
InChIKey
ZFZOBOFDMJTSMS-UHFFFAOYSA-N
Compound name
3-fluoronaphthalen-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

162.0481 Da
Monoisotopic Mass

2.4
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

No literature data available for this compound.

Patent stripe

patents stripe