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(1R,4R,5S)-4-Ethyl-2,9-dioxa-bicyclo(3.3.1)nonan-7-one

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(1R,4R,5S)-4-Ethyl-2,9-dioxa-bicyclo(3.3.1)nonan-7-one
SpectraBase Compound ID DyaNomd03aD
InChI InChI=1S/C9H14O3/c1-2-6-5-11-9-4-7(10)3-8(6)12-9/h6,8-9H,2-5H2,1H3
InChIKey KVTDOOCWWXLMJS-UHFFFAOYSA-N
Mol Weight 170.21 g/mol
Molecular Formula C9H14O3
Exact Mass 170.094294 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID x2TTXGMJyK
Name (1R,4S,5S)-4-ETHYL-2,9-DIOXABICYCLO[3.3.1]NONAN-7-ONE
Source of Sample S. J. Danishefsky, W. H. Pearson, D. Harvey J. Amer. Chem. Soc. 107, 1256(1985)
CAS Registry Number 91860-95-6
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14O3
InChI InChI=1S/C9H14O3/c1-2-6-5-11-9-4-7(10)3-8(6)12-9/h6,8-9H,2-5H2,1H3
InChIKey KVTDOOCWWXLMJS-UHFFFAOYSA-N
Molecular Weight 170.21
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WH-500
Synonyms 2,9-DIOXABICYCLO/3.3.1/NONAN-7-ONE, 4-ETHYL-, /1R,4S,5S/-,