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1-(5,6-dimethoxybenzothiophen-2-yl)ethanone (autogenerated)
SpectraBase Compound ID I7JXusofJUE
InChI InChI=1S/C12H12O3S/c1-7(13)11-5-8-4-9(14-2)10(15-3)6-12(8)16-11/h4-6H,1-3H3
InChIKey ZJNGZYDPTMVIAL-UHFFFAOYSA-N
Mol Weight 236.28 g/mol
Molecular Formula C12H12O3S
Exact Mass 236.050715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CXGTgvWyLNE
Name 1-(5,6-dimethoxybenzothiophen-2-yl)ethanone (autogenerated)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12O3S
InChI InChI=1S/C12H12O3S/c1-7(13)11-5-8-4-9(14-2)10(15-3)6-12(8)16-11/h4-6H,1-3H3
InChIKey ZJNGZYDPTMVIAL-UHFFFAOYSA-N
Instrument Name AccuTOF CS
Ionization Type EI
Literature Reference DOI 10.1021/jm901685n
Molecular Weight 236.285 g/mol
SMILES c1(cc2c(cc1OC)sc(c2)C(C)=O)OC
SPLASH splash10-00dr-9740000000-f85a96f826f643c21447
Source of Spectrum AF-53-SM6-14
Wiley ID 1846352