CID 39998

(1r)-(+)-7-hydroxy-6-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline hydrochloride

Structural Information

Molecular Formula
C11H15NO2
SMILES
C[C@@H]1C2=CC(=C(C=C2CCN1)OC)O
InChI
InChI=1S/C11H15NO2/c1-7-9-6-10(13)11(14-2)5-8(9)3-4-12-7/h5-7,12-13H,3-4H2,1-2H3/t7-/m1/s1
InChIKey
CBMULJVNWNTWJM-SSDOTTSWSA-N
Compound name
(1R)-6-methoxy-1-methyl-1,2,3,4-tetrahydroisoquinolin-7-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

5
References

0
Patents

193.11028 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 194.11756 141.8
[M+Na]+ 216.09950 154.5
[M+NH4]+ 211.14410 150.3
[M+K]+ 232.07344 148.2
[M-H]- 192.10300 143.3
[M+Na-2H]- 214.08495 146.6
[M]+ 193.10973 143.9
[M]- 193.11083 143.9
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

No patent data available for this compound.