CID 131753005

Mahanimbinol

Structural Information

Molecular Formula
C23H27NO
SMILES
CC1=CC2=C(C(=C1O)C/C=C(/C)\CCC=C(C)C)NC3=CC=CC=C32
InChI
InChI=1S/C23H27NO/c1-15(2)8-7-9-16(3)12-13-19-22-20(14-17(4)23(19)25)18-10-5-6-11-21(18)24-22/h5-6,8,10-12,14,24-25H,7,9,13H2,1-4H3/b16-12-
InChIKey
JSSIAXXILAGJKE-VBKFSLOCSA-N
Compound name
1-[(2Z)-3,7-dimethylocta-2,6-dienyl]-3-methyl-9H-carbazol-2-ol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

45
Patents

333.20926 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 334.216536 186.2
[M+Na]+ 356.198478 194.0
[M-H]- 332.201984 187.7
[M+NH4]+ 351.243083 202.0
[M+K]+ 372.172418 185.8
[M+H-H2O]+ 316.206520 179.3
[M+HCOO]- 378.207461 202.0
[M+CH3COO]- 392.223111 211.1
[M+Na-2H]- 354.183926 185.1
[M]+ 333.20871142 187.7
[M]- 333.20980858 187.7
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.