CID 3438622

8,9-dimethoxy-2,3,5,6-tetrahydropyrrolo[2,1-a]isoquinoline

Structural Information

Molecular Formula
C14H17NO2
SMILES
COC1=C(C=C2C(=C1)CCN3C2=CCC3)OC
InChI
InChI=1S/C14H17NO2/c1-16-13-8-10-5-7-15-6-3-4-12(15)11(10)9-14(13)17-2/h4,8-9H,3,5-7H2,1-2H3
InChIKey
FSOLZHFKZVHCCX-UHFFFAOYSA-N
Compound name
8,9-dimethoxy-2,3,5,6-tetrahydropyrrolo[2,1-a]isoquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.12593 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.13321 151.5
[M+Na]+ 254.11515 164.5
[M+NH4]+ 249.15975 161.2
[M+K]+ 270.08909 158.8
[M-H]- 230.11865 154.1
[M+Na-2H]- 252.10060 156.2
[M]+ 231.12538 154.1
[M]- 231.12648 154.1
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

No patent data available for this compound.