CID 97487

Koenimbine

Structural Information

Molecular Formula
C19H19NO2
SMILES
CC1=CC2=C(C3=C1OC(C=C3)(C)C)NC4=C2C=C(C=C4)OC
InChI
InChI=1S/C19H19NO2/c1-11-9-15-14-10-12(21-4)5-6-16(14)20-17(15)13-7-8-19(2,3)22-18(11)13/h5-10,20H,1-4H3
InChIKey
OSERHKINMDLESD-UHFFFAOYSA-N
Compound name
8-methoxy-3,3,5-trimethyl-11H-pyrano[3,2-a]carbazole
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

10
References

18
Patents

293.14157 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.14885 168.1
[M+Na]+ 316.13079 184.7
[M+NH4]+ 311.17539 179.4
[M+K]+ 332.10473 176.0
[M-H]- 292.13429 173.2
[M+Na-2H]- 314.11624 174.4
[M]+ 293.14102 172.4
[M]- 293.14212 172.4
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