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MILIUSOLIDE;(3AS*,5S*,7AR*)-5-BENZOYLOXY-3A,4,5,7A-TETRAHYDRO-3H-BENZOFURAN-2-ONE
SpectraBase Compound ID IvfshrfmAa
InChI InChI=1S/C15H14O4/c16-14-9-11-8-12(6-7-13(11)19-14)18-15(17)10-4-2-1-3-5-10/h1-7,11-13H,8-9H2/t11-,12+,13-/m0/s1
InChIKey GUAAVFCFGIYUNB-XQQFMLRXSA-N
Mol Weight 258.27 g/mol
Molecular Formula C15H14O4
Exact Mass 258.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8rij2t2xQVb
Name (3aS*,5S*,7aR*)-5-Benzoyloxy-3a,4,5,7a-tetrahydro-3H-benzofuran-2-one
Appearance Colorless crystals
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Formula C15H14O4
InChI InChI=1S/C15H14O4/c16-14-9-11-8-12(6-7-13(11)19-14)18-15(17)10-4-2-1-3-5-10/h1-7,11-13H,8-9H2/t11-,12+,13-/m0/s1
InChIKey GUAAVFCFGIYUNB-XQQFMLRXSA-N
Instrument Name HP 5989B
Ionization Type EI
Literature Reference DOI 10.1021/np030195z
Molecular Weight 258.273 g/mol
Reported Formula C15H14O4
SMILES C(c1ccccc1)(=O)O[C@]1(C[C@@]2([C@](C=C1)(OC(C2)=O)[H])[H])[H]
SPLASH splash10-0a6u-9600000000-8f691f2ec41d25542c4e
Source of Spectrum G4-67-447-2
Synonyms Miliusolide
Wiley ID 1881673