CID 196885

Litebamine

Structural Information

Molecular Formula
C20H21NO4
SMILES
CN1CCC2=C3C=CC4=CC(=C(C=C4C3=C(C(=C2C1)O)OC)OC)O
InChI
InChI=1S/C20H21NO4/c1-21-7-6-12-13-5-4-11-8-16(22)17(24-2)9-14(11)18(13)20(25-3)19(23)15(12)10-21/h4-5,8-9,22-23H,6-7,10H2,1-3H3
InChIKey
QOWFEPGZJDCIKG-UHFFFAOYSA-N
Compound name
9,11-dimethoxy-2-methyl-3,4-dihydro-1H-naphtho[2,1-f]isoquinoline-8,12-diol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

3
References

0
Patents

339.14706 Da
Monoisotopic Mass

3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 340.15434 180.1
[M+Na]+ 362.13628 196.2
[M+NH4]+ 357.18088 188.6
[M+K]+ 378.11022 188.2
[M-H]- 338.13978 183.3
[M+Na-2H]- 360.12173 184.3
[M]+ 339.14651 183.5
[M]- 339.14761 183.5
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.