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(1R,4S,5S,6S,9S)-9-Ethyl-5-(ethoxycarbonyl)-4-methyl-7-oxo-8-oxabicyclo[4.3.0]non-2-ene
SpectraBase Compound ID B9Hs2bOpmef
InChI InChI=1S/C14H20O4/c1-4-10-9-7-6-8(3)11(13(15)17-5-2)12(9)14(16)18-10/h6-12H,4-5H2,1-3H3/t8-,9+,10-,11-,12+/m0/s1
InChIKey BUSDCRSHQKPZMF-KZZRWZIVSA-N
Mol Weight 252.31 g/mol
Molecular Formula C14H20O4
Exact Mass 252.136159 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JssaH58Lu6S
Name (1R,4S,5S,6S,9S)-9-Ethyl-5-(ethoxycarbonyl)-4-methyl-7-oxo-8-oxabicyclo[4.3.0]non-2-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20O4
InChI InChI=1S/C14H20O4/c1-4-10-9-7-6-8(3)11(13(15)17-5-2)12(9)14(16)18-10/h6-12H,4-5H2,1-3H3/t8-,9+,10-,11-,12+/m0/s1
InChIKey BUSDCRSHQKPZMF-KZZRWZIVSA-N
Molecular Weight 252.310 g/mol
SMILES C1([C@@]2([C@@](C=C[C@@]([C@@]2(C(=O)OCC)[H])(C)[H])([H])[C@@](O1)(CC)[H])[H])=O
SPLASH splash10-054o-9730000000-5cec7e40ec4a9468d185
Source of Spectrum F-53-1012-20
Synonyms Ethyl (3aR,7aS)-1-ethyl-5-methyl-3-oxo-1,3,3a,4,5,7a-hexahydro-2-benzofuran-4-carboxylate trans-9-Ethyl-5-(ethoxycarbonyl)-4-methyl-7-oxo-8-oxabicyclo[4.3.0]non-2-ene
Wiley ID 800169