For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

(1S,3aS,3bS,5aR,9aR,9bS,11aS)-1-(isobutylamino)-6,9a,11a-trimethyl-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-7-one

View entire compound with spectra: 1 NMR, and 1 MS (GC)

(1S,3aS,3bS,5aR,9aR,9bS,11aS)-1-(isobutylamino)-6,9a,11a-trimethyl-2,3,3a,3b,4,5,5a,8,9,9b,10,11-dodecahydro-1H-indeno[5,4-f]quinolin-7-one
SpectraBase Compound ID HgeYXHkqLNl
InChI InChI=1S/C23H40N2O/c1-15(2)14-24-19-8-7-17-16-6-9-20-23(4,13-11-21(26)25(20)5)18(16)10-12-22(17,19)3/h15-20,24H,6-14H2,1-5H3/t16-,17-,18-,19-,20+,22-,23+/m0/s1
InChIKey LKMGCGAXJNZOTQ-PAANBGOBSA-N
Mol Weight 360.6 g/mol
Molecular Formula C23H40N2O
Exact Mass 360.314064 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Hxng9VBZ8PM
Name (1S,3as,3bs,5ar,9ar,9bs,11As)-1-(isobutylamino)-6,9A,11A-trimethyl-2,3,3A,3B,4,5,5A,8,9,9B,10,11-dodecahydro-1H-indeno[5,4-F]quinolin-7-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 360.314063915 u
Formula C23H40N2O
InChI InChI=1S/C23H40N2O/c1-15(2)14-24-19-8-7-17-16-6-9-20-23(4,13-11-21(26)25(20)5)18(16)10-12-22(17,19)3/h15-20,24H,6-14H2,1-5H3/t16-,17-,18-,19-,20+,22-,23+/m0/s1
InChIKey LKMGCGAXJNZOTQ-PAANBGOBSA-N
Molecular Weight 360.586 g/mol
SMILES [C@@]12([C@](N(C)C(CC2)=O)(CC[C@]2([C@@]3(CC[C@@]([C@]3(CC[C@]12[H])C)(NCC(C)C)[H])[H])[H])[H])C