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3-Furancarboxylic acid, 2-ethenyltetrahydro-5-phenyl-, methyl ester, (2.alpha.,3.alpha.,5.alpha.)-(.+-.)-
SpectraBase Compound ID Fub8dJHB80V
InChI InChI=1S/C14H16O3/c1-3-12-11(14(15)16-2)9-13(17-12)10-7-5-4-6-8-10/h3-8,11-13H,1,9H2,2H3/t11-,12-,13+/m1/s1
InChIKey RAZYYAASOQPUDI-UPJWGTAASA-N
Mol Weight 232.28 g/mol
Molecular Formula C14H16O3
Exact Mass 232.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2Yuwjsm4Tg
Name 3-Furancarboxylic acid, 2-ethenyltetrahydro-5-phenyl-, methyl ester, (2.alpha.,3.alpha.,5.alpha.)-(.+-.)-
Alternate Name(s) (+-)-(2S*,4R*,5R*)-tetrahydro-4-carbomethoxy-2-phenyl-5-vinylfuran methyl (2R,3R,5S)-5-phenyl-2-vinyltetrahydro-3-furancarboxylate
CAS Registry Number 124571-10-4
Comments Less than 3 mono-isotopic peaks
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Formula C14H16O3
InChI InChI=1S/C14H16O3/c1-3-12-11(14(15)16-2)9-13(17-12)10-7-5-4-6-8-10/h3-8,11-13H,1,9H2,2H3/t11-,12-,13+/m1/s1
InChIKey RAZYYAASOQPUDI-UPJWGTAASA-N
Molecular Weight 232.279 g/mol
SMILES [C@]1([C@](O[C@@](C1)(c1ccccc1)[H])(C=C)[H])(C(=O)OC)[H]
SPLASH splash10-0udi-0090000000-c77bbfcec1285cb55f17
Source of Spectrum F-45-2973-9
Wiley ID 1233951