CID 78172954

2,10,11-trimethoxy-5,6,6a,7-tetrahydro-4h-dibenzo[de,g]quinolin-1-ol

Structural Information

Molecular Formula
C19H21NO4
SMILES
COC1=C(C2=C(CC3C4=C2C(=C(C=C4CCN3)OC)O)C=C1)OC
InChI
InChI=1S/C19H21NO4/c1-22-13-5-4-10-8-12-15-11(6-7-20-12)9-14(23-2)18(21)17(15)16(10)19(13)24-3/h4-5,9,12,20-21H,6-8H2,1-3H3
InChIKey
HVMMFGYMZZVURQ-UHFFFAOYSA-N
Compound name
2,10,11-trimethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-1-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

0
Patents

327.14706 Da
Monoisotopic Mass

2.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 328.15434 176.6
[M+Na]+ 350.13628 184.3
[M-H]- 326.13978 178.0
[M+NH4]+ 345.18088 191.6
[M+K]+ 366.11022 179.6
[M+H-H2O]+ 310.14432 168.3
[M+HCOO]- 372.14526 188.7
[M+CH3COO]- 386.16091 186.0
[M+Na-2H]- 348.12173 181.2
[M]+ 327.14651 178.5
[M]- 327.14761 178.5
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.