CID 84652630

6-fluoro-1,2,3,4-tetrahydroisoquinolin-7-ol hydrochloride

Structural Information

Molecular Formula
C9H10FNO
SMILES
C1CNCC2=CC(=C(C=C21)F)O
InChI
InChI=1S/C9H10FNO/c10-8-3-6-1-2-11-5-7(6)4-9(8)12/h3-4,11-12H,1-2,5H2
InChIKey
GTBACGNJBJHFNC-UHFFFAOYSA-N
Compound name
6-fluoro-1,2,3,4-tetrahydroisoquinolin-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

167.07465 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.081926 132.4
[M+Na]+ 190.063868 140.4
[M-H]- 166.067374 131.5
[M+NH4]+ 185.108473 151.6
[M+K]+ 206.037808 136.2
[M+H-H2O]+ 150.071910 125.8
[M+HCOO]- 212.072851 148.9
[M+CH3COO]- 226.088501 144.4
[M+Na-2H]- 188.049316 139.0
[M]+ 167.07410142 126.2
[M]- 167.07519858 126.2
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