CID 56597

93203-08-8

Structural Information

Molecular Formula
C15H15NO2
SMILES
C1CNC(C2=C1C=C(C=C2)O)C3=CC=CC=C3O
InChI
InChI=1S/C15H15NO2/c17-11-5-6-12-10(9-11)7-8-16-15(12)13-3-1-2-4-14(13)18/h1-6,9,15-18H,7-8H2
InChIKey
LNSAOSCDGAOPNZ-UHFFFAOYSA-N
Compound name
1-(2-hydroxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

241.11028 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 242.11756 153.9
[M+Na]+ 264.09950 160.8
[M-H]- 240.10300 156.0
[M+NH4]+ 259.14410 169.0
[M+K]+ 280.07344 154.7
[M+H-H2O]+ 224.10754 146.5
[M+HCOO]- 286.10848 169.4
[M+CH3COO]- 300.12413 164.3
[M+Na-2H]- 262.08495 159.2
[M]+ 241.10973 148.3
[M]- 241.11083 148.3
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

No patent data available for this compound.