CID 5209

Mukoenine a

Structural Information

Molecular Formula
C18H19NO
SMILES
CC1=CC2=C(C(=C1O)CC=C(C)C)NC3=CC=CC=C32
InChI
InChI=1S/C18H19NO/c1-11(2)8-9-14-17-15(10-12(3)18(14)20)13-6-4-5-7-16(13)19-17/h4-8,10,19-20H,9H2,1-3H3
InChIKey
PURITTXNCHNYEP-UHFFFAOYSA-N
Compound name
3-methyl-1-(3-methylbut-2-enyl)-9H-carbazol-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

92
Patents

265.14667 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.15395 163.2
[M+Na]+ 288.13589 177.6
[M+NH4]+ 283.18049 171.9
[M+K]+ 304.10983 171.2
[M-H]- 264.13939 165.4
[M+Na-2H]- 286.12134 168.0
[M]+ 265.14612 165.9
[M]- 265.14722 165.9
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