CID 366739

Nsc635461

Structural Information

Molecular Formula
C20H19NO4
SMILES
COC1=C(C=C2C(=C1)C=CN3C2=CC4=CC(=C(C=C43)OC)OC)OC
InChI
InChI=1S/C20H19NO4/c1-22-17-8-12-5-6-21-15-11-20(25-4)18(23-2)9-13(15)7-16(21)14(12)10-19(17)24-3/h5-11H,1-4H3
InChIKey
XNRNTISMBNPOTJ-UHFFFAOYSA-N
Compound name
2,3,9,10-tetramethoxyindolo[2,1-a]isoquinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

337.1314 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 338.138676 178.7
[M+Na]+ 360.120618 191.8
[M-H]- 336.124124 185.6
[M+NH4]+ 355.165223 196.8
[M+K]+ 376.094558 187.5
[M+H-H2O]+ 320.128660 170.5
[M+HCOO]- 382.129601 201.4
[M+CH3COO]- 396.145251 191.8
[M+Na-2H]- 358.106066 184.8
[M]+ 337.13085142 190.5
[M]- 337.13194858 190.5
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.