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2-Ethoxycarbonyl-2-(3-thienyl)-4-phenylbutyrolactone

View entire compound with spectra: 2 MS (GC)

2-Ethoxycarbonyl-2-(3-thienyl)-4-phenylbutyrolactone
SpectraBase Compound ID KSdbVs4M2Tn
InChI InChI=1S/C17H16O4S/c1-2-20-15(18)17(13-8-9-22-11-13)10-14(21-16(17)19)12-6-4-3-5-7-12/h3-9,11,14H,2,10H2,1H3
InChIKey SJFXTXPRUXJDGL-UHFFFAOYSA-N
Mol Weight 316.37 g/mol
Molecular Formula C17H16O4S
Exact Mass 316.07693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4FbMg56yHI
Name 2-Ethoxycarbonyl-2-(3-thienyl)-4-phenylbutyrolactone
Alternate Name(s) 2-Ethoxycarbonyl-2-(3-thienyl)-4-phenylbutyrolactone isomer Ethyl 2-oxo-5-phenyl-3-(3-thienyl)tetrahydro-3-furancarboxylate
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Formula C17H16O4S
InChI InChI=1S/C17H16O4S/c1-2-20-15(18)17(13-8-9-22-11-13)10-14(21-16(17)19)12-6-4-3-5-7-12/h3-9,11,14H,2,10H2,1H3
InChIKey SJFXTXPRUXJDGL-UHFFFAOYSA-N
Molecular Weight 316.371 g/mol
SMILES C1(C(OC(C1)c1ccccc1)=O)(c1cscc1)C(=O)OCC
SPLASH splash10-056s-0960000000-363a46a3ac4b422cbacf
Source of Spectrum F-52-13238-14
Wiley ID 799253