CID 22296208

11-methoxyeburnamonine

Structural Information

Molecular Formula
C20H24N2O2
SMILES
CC[C@]12CCCN3[C@H]1C4=C(CC3)C5=C(N4C(=O)C2)C=C(C=C5)OC
InChI
InChI=1S/C20H24N2O2/c1-3-20-8-4-9-21-10-7-15-14-6-5-13(24-2)11-16(14)22(17(23)12-20)18(15)19(20)21/h5-6,11,19H,3-4,7-10,12H2,1-2H3/t19-,20+/m0/s1
InChIKey
QAJSPAOAMMRBED-VQTJNVASSA-N
Compound name
(15R,19R)-15-ethyl-4-methoxy-1,11-diazapentacyclo[9.6.2.02,7.08,18.015,19]nonadeca-2(7),3,5,8(18)-tetraen-17-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

324.18378 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 325.191056 178.0
[M+Na]+ 347.172998 185.8
[M-H]- 323.176504 180.1
[M+NH4]+ 342.217603 197.6
[M+K]+ 363.146938 179.7
[M+H-H2O]+ 307.181040 168.0
[M+HCOO]- 369.181981 188.8
[M+CH3COO]- 383.197631 187.3
[M+Na-2H]- 345.158446 181.7
[M]+ 324.18323142 178.7
[M]- 324.18432858 178.7
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.