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3,5-Methano-4H-cyclopenta[b]furan-4-one, 6a-ethoxyhexahydro-7-propyl-, (3.alpha.,3a.beta.,5.alpha.,6a.beta.,7S*)-(.+-.)-
SpectraBase Compound ID 4zq7GVhIMVW
InChI InChI=1S/C13H20O3/c1-3-5-8-9-6-13(15-4-2)11(12(9)14)10(8)7-16-13/h8-11H,3-7H2,1-2H3/t8-,9+,10-,11-,13+/m0/s1
InChIKey FBVALKAXVOKZFO-DKQSBRCMSA-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 KTfSKxjQN1q
Name 3,5-Methano-4H-cyclopenta[b]furan-4-one, 6a-ethoxyhexahydro-7-propyl-, (3.alpha.,3a.beta.,5.alpha.,6a.beta.,7S*)-(.+-.)-
CAS Registry Number 123773-70-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O3
InChI InChI=1S/C13H20O3/c1-3-5-8-9-6-13(15-4-2)11(12(9)14)10(8)7-16-13/h8-11H,3-7H2,1-2H3/t8-,9+,10-,11-,13+/m0/s1
InChIKey FBVALKAXVOKZFO-DKQSBRCMSA-N
Molecular Weight 224.300 g/mol
SMILES [C@]12([C@@]3(C(=O)[C@](C2)([C@](CCC)([C@]3([H])CO1)[H])[H])[H])OCC
SPLASH splash10-03dr-6900000000-967d78bfbdaa45892b9e
Source of Spectrum F-45-1402-13
Synonyms (+-)-(1R*,4S*,5R*,6R*,8S*)-1-ethoxy-5-propyl-2-oxatricyclo[4.2.1.0(4,8)]nonan-7-one (1R,3R,6S,7S,9R)-3-ethoxy-9-propyl-4-oxatricyclo[4.2.1.0(3,7)]nonan-8-one
Wiley ID 1225290