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RE-1-R,9-S-1,10,10-TRIMETHYLBICYCLO-[7.4.0]-TRIDECANE-3,6-DIONE
SpectraBase Compound ID 6KLrW8o9sU4
InChI InChI=1S/C16H26O2/c1-15(2)9-4-10-16(3)11-13(18)6-5-12(17)7-8-14(15)16/h14H,4-11H2,1-3H3/t14-,16+/m0/s1
InChIKey JCABOSNDEYWKMH-GOEBONIOSA-N
Mol Weight 250.38 g/mol
Molecular Formula C16H26O2
Exact Mass 250.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JRH3JiZxnRM
Name (4aR,11aS)-1,1,4a-Trimethyl-decahydro-benzocyclononene-6,9-dione
Alternate Name(s) 1,10,10-Trimethylbicyclo[7.4.0]tridecane-3,6-dione (4aS,11aR)-4,4,11a-trimethyl-2,3,4a,5,6,8,9,11-octahydro-1H-benzo[9]annulene-7,10-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O2
InChI InChI=1S/C16H26O2/c1-15(2)9-4-10-16(3)11-13(18)6-5-12(17)7-8-14(15)16/h14H,4-11H2,1-3H3/t14-,16+/m0/s1
InChIKey JCABOSNDEYWKMH-GOEBONIOSA-N
Molecular Weight 250.382 g/mol
SMILES [C@@]12([C@](C(C)(C)CCC2)(CCC(=O)CCC(C1)=O)[H])C
SPLASH splash10-000f-9820000000-0c3afec80144393fe8dc
Source of Spectrum G4-69-1640-1
Wiley ID 1694596