CID 13948251

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

Structural Information

Molecular Formula
C9H11NO
SMILES
C1CNCC2=C1C(=CC=C2)O
InChI
InChI=1S/C9H11NO/c11-9-3-1-2-7-6-10-5-4-8(7)9/h1-3,10-11H,4-6H2
InChIKey
OMZHCCXUVSEGAD-UHFFFAOYSA-N
Compound name
1,2,3,4-tetrahydroisoquinolin-5-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

280
Patents

149.08406 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 150.09134 129.6
[M+Na]+ 172.07328 136.5
[M-H]- 148.07678 129.7
[M+NH4]+ 167.11788 149.2
[M+K]+ 188.04722 132.8
[M+H-H2O]+ 132.08132 123.7
[M+HCOO]- 194.08226 147.1
[M+CH3COO]- 208.09791 141.8
[M+Na-2H]- 170.05873 137.5
[M]+ 149.08351 124.1
[M]- 149.08461 124.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe