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(+)-CRASSALACTONE_D
SpectraBase Compound ID 7yfLLd29Mkh
InChI InChI=1S/C13H12O4/c14-10-8-13(7-6-11(15)16-13)17-12(10)9-4-2-1-3-5-9/h1-7,10,12,14H,8H2/t10-,12+,13-/m0/s1
InChIKey HQBGZDWOMDYFLH-UHTWSYAYSA-N
Mol Weight 232.23 g/mol
Molecular Formula C13H12O4
Exact Mass 232.073559 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I0OYp3LFfQH
Name (5S,7R,8S)-8-Hydroxy-7-phenyl-1,6-dioxa-spiro[4.4]non-3-en-2-one
Alternate Name(s) 2-Oxo-8-hydroxy-7-phenyl-1,6-dioxaspiro[4.4]non-3-ene Crassalactone D (5S,7R,8S)-8-oxidanyl-7-phenyl-1,6-dioxaspiro[4.4]non-3-en-2-one
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Formula C13H12O4
InChI InChI=1S/C13H12O4/c14-10-8-13(7-6-11(15)16-13)17-12(10)9-4-2-1-3-5-9/h1-7,10,12,14H,8H2/t10-,12+,13-/m0/s1
InChIKey HQBGZDWOMDYFLH-UHTWSYAYSA-N
Molecular Weight 232.235 g/mol
SMILES O[C@]1(C[C@@]2(OC(=O)C=C2)O[C@@]1(c1ccccc1)[H])[H]
SPLASH splash10-0a6r-5900000000-8a4ccc32d18ea79017a4
Source of Spectrum G4-69-1732-4
Wiley ID 1694579