CID 30835

Norglaucin

Structural Information

Molecular Formula
C20H23NO4
SMILES
COC1=C(C2=C3[C@H](CC4=CC(=C(C=C42)OC)OC)NCCC3=C1)OC
InChI
InChI=1S/C20H23NO4/c1-22-15-9-12-7-14-18-11(5-6-21-14)8-17(24-3)20(25-4)19(18)13(12)10-16(15)23-2/h8-10,14,21H,5-7H2,1-4H3/t14-/m0/s1
InChIKey
MZSUVQFIWWXTFR-AWEZNQCLSA-N
Compound name
(6aS)-1,2,9,10-tetramethoxy-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

28
Patents

341.16272 Da
Monoisotopic Mass

2.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 342.17000 181.2
[M+Na]+ 364.15194 188.8
[M-H]- 340.15544 183.7
[M+NH4]+ 359.19654 196.2
[M+K]+ 380.12588 184.7
[M+H-H2O]+ 324.15998 172.2
[M+HCOO]- 386.16092 194.4
[M+CH3COO]- 400.17657 190.7
[M+Na-2H]- 362.13739 185.6
[M]+ 341.16217 185.1
[M]- 341.16327 185.1
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

patents stripe