CID 10085008

Murrayamine a

Structural Information

Molecular Formula
C18H17NO2
SMILES
CC1=CC2=C(C3=C1OC(C=C3)(C)C)NC4=C2C=CC(=C4)O
InChI
InChI=1S/C18H17NO2/c1-10-8-14-12-5-4-11(20)9-15(12)19-16(14)13-6-7-18(2,3)21-17(10)13/h4-9,19-20H,1-3H3
InChIKey
RIEXGJSQJLHVLX-UHFFFAOYSA-N
Compound name
3,3,5-trimethyl-11H-pyrano[3,2-a]carbazol-9-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

7
Patents

279.12592 Da
Monoisotopic Mass

4.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 280.13320 163.8
[M+Na]+ 302.11514 180.1
[M+NH4]+ 297.15974 175.0
[M+K]+ 318.08908 172.0
[M-H]- 278.11864 168.5
[M+Na-2H]- 300.10059 169.8
[M]+ 279.12537 167.9
[M]- 279.12647 167.9
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