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(1R*,2R*,6R*,8S*)-2-Carbethoxy-8-methyl-7-oxobicyclo[4.3.0]nonane
SpectraBase Compound ID 782O1bYKvOq
InChI InChI=1S/C13H20O3/c1-3-16-13(15)10-6-4-5-9-11(10)7-8(2)12(9)14/h8-11H,3-7H2,1-2H3/t8-,9+,10+,11+/m0/s1
InChIKey PNSPHJDRUSECML-LNFKQOIKSA-N
Mol Weight 224.3 g/mol
Molecular Formula C13H20O3
Exact Mass 224.141245 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BwIg3vnqF5Q
Name (1R*,2R*,6R*,8S*)-2-Carbethoxy-8-methyl-7-oxobicyclo[4.3.0]nonane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-3-16-13(15)10-6-4-5-9-11(10)7-8(2)12(9)14/h8-11H,3-7H2,1-2H3/t8-,9+,10+,11+/m0/s1
InChIKey PNSPHJDRUSECML-LNFKQOIKSA-N
Molecular Weight 224.300 g/mol
SMILES [C@]12([C@](C(=O)[C@](C2)(C)[H])(CCC[C@]1(C(=O)OCC)[H])[H])[H]
SPLASH splash10-0ugi-8920000000-083197b2541bd34396f3
Source of Spectrum C-115-5952-29
Synonyms Ethyl (2S,3aR,4R,7aR)-2-methyl-1-oxooctahydro-1H-indene-4-carboxylate
Wiley ID 1225373