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(1R*,2S*,5S*)-2-(Ethoxycarbonyl)-2-methyl-5-propyl-8-oxabicyclo[3.2.1]oct-3-one
SpectraBase Compound ID JoUVxH5f13S
InChI InChI=1S/C14H22O4/c1-4-7-14-8-6-11(18-14)13(3,10(15)9-14)12(16)17-5-2/h11H,4-9H2,1-3H3/t11-,13-,14+/m1/s1
InChIKey KVRAGNMPWVERCM-BNOWGMLFSA-N
Mol Weight 254.33 g/mol
Molecular Formula C14H22O4
Exact Mass 254.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWwjKgroYxT
Name (1R*,2S*,5S*)-2-(Ethoxycarbonyl)-2-methyl-5-propyl-8-oxabicyclo[3.2.1]oct-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O4
InChI InChI=1S/C14H22O4/c1-4-7-14-8-6-11(18-14)13(3,10(15)9-14)12(16)17-5-2/h11H,4-9H2,1-3H3/t11-,13-,14+/m1/s1
InChIKey KVRAGNMPWVERCM-BNOWGMLFSA-N
Molecular Weight 254.326 g/mol
SMILES [C@@]1(C(C[C@]2(O[C@@]1(CC2)[H])CCC)=O)(C(=O)OCC)C
SPLASH splash10-0002-9100000000-2ce33c19fea28af7d8a8
Source of Spectrum C-115-842-14
Synonyms Ethyl (1R,2S,5S)-2-methyl-3-oxo-5-propyl-8-oxabicyclo[3.2.1]octane-2-carboxylate
Wiley ID 1257739