CID 20034539

Ns00116719

Structural Information

Molecular Formula
C23H36N2O3
SMILES
CC12CCC3C(C1CCC2C(=O)NC(C)(C)CO)CCC4C3(C=CC(=O)N4)C
InChI
InChI=1S/C23H36N2O3/c1-21(2,13-26)25-20(28)17-7-6-15-14-5-8-18-23(4,12-10-19(27)24-18)16(14)9-11-22(15,17)3/h10,12,14-18,26H,5-9,11,13H2,1-4H3,(H,24,27)(H,25,28)
InChIKey
MFUJYZCMHDCXGQ-UHFFFAOYSA-N
Compound name
N-(1-hydroxy-2-methylpropan-2-yl)-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

388.27258 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.27986 195.1
[M+Na]+ 411.26180 200.3
[M+NH4]+ 406.30640 204.3
[M+K]+ 427.23574 193.6
[M-H]- 387.26530 194.8
[M+Na-2H]- 409.24725 195.1
[M]+ 388.27203 195.6
[M]- 388.27313 195.6
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.