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(S)-3-(Thiophen-3-yl)-1,3-dihydro-2-benzofuran-1-one
SpectraBase Compound ID BWuiCayvzh1
InChI InChI=1S/C12H8O2S/c13-12-10-4-2-1-3-9(10)11(14-12)8-5-6-15-7-8/h1-7,11H/t11-/m1/s1
InChIKey PDCGGTHNVMVBAN-LLVKDONJSA-N
Mol Weight 216.25 g/mol
Molecular Formula C12H8O2S
Exact Mass 216.024501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DWNEEkwx1Zf
Name (S)-3-(Thiophen-3-yl)-1,3-dihydro-2-benzofuran-1-one
Alternate Name(s) (S)-3-(thiophen-3-yl)isobenzofuran-1(3H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H8O2S
InChI InChI=1S/C12H8O2S/c13-12-10-4-2-1-3-9(10)11(14-12)8-5-6-15-7-8/h1-7,11H/t11-/m1/s1
InChIKey PDCGGTHNVMVBAN-LLVKDONJSA-N
Literature Reference DOI 10.1039/C5OB01661D
Molecular Weight 216.254 g/mol
SMILES C1(O[C@@](c2c1cccc2)(c1cscc1)[H])=O
SPLASH splash10-06di-1960000000-2100e11fc8aff05d1f6a
Source of Spectrum F5-13-10878-3al
Wiley ID 1802052