CID 69178897

6-(2-methoxyethoxy)-1,2,3,4-tetrahydroisoquinoline hydrochloride

Structural Information

Molecular Formula
C12H17NO2
SMILES
COCCOC1=CC2=C(CNCC2)C=C1
InChI
InChI=1S/C12H17NO2/c1-14-6-7-15-12-3-2-11-9-13-5-4-10(11)8-12/h2-3,8,13H,4-7,9H2,1H3
InChIKey
GRPUMXBYKZBGOO-UHFFFAOYSA-N
Compound name
6-(2-methoxyethoxy)-1,2,3,4-tetrahydroisoquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

207.12593 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 208.13321 146.5
[M+Na]+ 230.11515 158.8
[M+NH4]+ 225.15975 155.2
[M+K]+ 246.08909 151.5
[M-H]- 206.11865 148.4
[M+Na-2H]- 228.10060 152.1
[M]+ 207.12538 148.7
[M]- 207.12648 148.7
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