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2H-Cyclohepta[b]furan-2-one, 8-(acetyloxy)octahydro-3-methylene-, (3a.alpha.,8.beta.,8a.alpha.)-
SpectraBase Compound ID 5RGo5Yut32F
InChI InChI=1S/C12H16O4/c1-8-10-6-4-3-5-7-12(10,15-9(2)13)16-11(8)14/h10H,1,3-7H2,2H3/t10-,12-/m1/s1
InChIKey KWICTKLODBHGNZ-ZYHUDNBSSA-N
Mol Weight 224.26 g/mol
Molecular Formula C12H16O4
Exact Mass 224.104859 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 72phcTspbS2
Name 2H-Cyclohepta[b]furan-2-one, 8-(acetyloxy)octahydro-3-methylene-, (3a.alpha.,8.beta.,8a.alpha.)-
CAS Registry Number 107115-54-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H16O4
InChI InChI=1S/C12H16O4/c1-8-10-6-4-3-5-7-12(10,15-9(2)13)16-11(8)14/h10H,1,3-7H2,2H3/t10-,12-/m1/s1
InChIKey KWICTKLODBHGNZ-ZYHUDNBSSA-N
Molecular Weight 224.256 g/mol
SMILES [C@]12(OC(=O)C([C@]2(CCCCC1)[H])=C)OC(=O)C
SPLASH splash10-03di-0900000000-b42a2e3066a7e6ee0817
Source of Spectrum J-52-1436-14
Synonyms (3a.alpha.,8a.alpha.)-8.beta.-acetoxy-3-methyleneoctahydro-2H-cyclohepta[b]furan-2-one (3aR,8aR)-3-methylene-2-oxooctahydro-8aH-cyclohepta[b]furan-8a-yl acetate
Wiley ID 1224992