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4,4,8,9A-Tetramethyl-9-[2'-(2'',5''-dioxo-2'',5''-dihydro-4''-furyl)ethyl]-octahydronaphthalen-7-one
SpectraBase Compound ID GIDwvJlGYXF
InChI InChI=1S/C20H26O4/c1-12-14(7-6-13-10-17(22)24-18(13)23)20(4)9-5-8-19(2,3)16(20)11-15(12)21/h10,16H,5-9,11H2,1-4H3/t16-,20+/m0/s1
InChIKey PSCJVSVZDDKAQE-OXJNMPFZSA-N
Mol Weight 330.42 g/mol
Molecular Formula C20H26O4
Exact Mass 330.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HLVHbJhk1YP
Name 4,4,8,9A-Tetramethyl-9-[2'-(2'',5''-dioxo-2'',5''-dihydro-4''-furyl)ethyl]-octahydronaphthalen-7-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 330.183109313 u
Formula C20H26O4
InChI InChI=1S/C20H26O4/c1-12-14(7-6-13-10-17(22)24-18(13)23)20(4)9-5-8-19(2,3)16(20)11-15(12)21/h10,16H,5-9,11H2,1-4H3/t16-,20+/m0/s1
InChIKey PSCJVSVZDDKAQE-OXJNMPFZSA-N
Molecular Weight 330.424 g/mol
SMILES C=1([C@@]2([C@@](C(C)(C)CCC2)([H])CC(C1C)=O)C)CCC=1C(OC(C1)=O)=O