CID 84652626

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

Structural Information

Molecular Formula
C9H10FNO
SMILES
C1CNCC2=C1C(=C(C=C2)O)F
InChI
InChI=1S/C9H10FNO/c10-9-7-3-4-11-5-6(7)1-2-8(9)12/h1-2,11-12H,3-5H2
InChIKey
VMADJVSFGPLQRV-UHFFFAOYSA-N
Compound name
5-fluoro-1,2,3,4-tetrahydroisoquinolin-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

167.07465 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 168.08193 132.4
[M+Na]+ 190.06387 140.4
[M-H]- 166.06737 131.5
[M+NH4]+ 185.10847 151.6
[M+K]+ 206.03781 136.2
[M+H-H2O]+ 150.07191 125.8
[M+HCOO]- 212.07285 148.9
[M+CH3COO]- 226.08850 144.4
[M+Na-2H]- 188.04932 139.0
[M]+ 167.07410 126.2
[M]- 167.07520 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