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(1R*,2S*,5S*)-2-(Ethoxycarbonyl)-2-isopropyl-5-propyl-8-oxabicyclo[3.2.1]oct-3-one
SpectraBase Compound ID FO5CDO81MS5
InChI InChI=1S/C16H26O4/c1-5-8-15-9-7-13(20-15)16(11(3)4,12(17)10-15)14(18)19-6-2/h11,13H,5-10H2,1-4H3/t13-,15+,16-/m1/s1
InChIKey NRTISDBQAVUYDO-VNQPRFMTSA-N
Mol Weight 282.38 g/mol
Molecular Formula C16H26O4
Exact Mass 282.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BWAqsHgwtUt
Name (1R*,2S*,5S*)-2-(Ethoxycarbonyl)-2-isopropyl-5-propyl-8-oxabicyclo[3.2.1]oct-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H26O4
InChI InChI=1S/C16H26O4/c1-5-8-15-9-7-13(20-15)16(11(3)4,12(17)10-15)14(18)19-6-2/h11,13H,5-10H2,1-4H3/t13-,15+,16-/m1/s1
InChIKey NRTISDBQAVUYDO-VNQPRFMTSA-N
Molecular Weight 282.380 g/mol
SMILES [C@@]1(C(C[C@]2(O[C@@]1(CC2)[H])CCC)=O)(C(=O)OCC)C(C)C
SPLASH splash10-006x-7920000000-c7c92cf0d8ab61da800f
Source of Spectrum C-115-843-14
Synonyms Ethyl (1R,2S,5S)-2-isopropyl-3-oxo-5-propyl-8-oxabicyclo[3.2.1]octane-2-carboxylate
Wiley ID 1285978