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(E)-3-(5-bromothiophen-2-yl)allyl acetate
SpectraBase Compound ID BwweAUd3f1J
InChI InChI=1S/C9H9BrO2S/c1-7(11)12-6-2-3-8-4-5-9(10)13-8/h2-5H,6H2,1H3/b3-2+
InChIKey DKFBBJAEZMXZHD-NSCUHMNNSA-N
Mol Weight 261.13 g/mol
Molecular Formula C9H9BrO2S
Exact Mass 259.950664 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 18tPPouyfr
Name (E)-3-(5-bromothiophen-2-yl)allyl acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H9BrO2S
InChI InChI=1S/C9H9BrO2S/c1-7(11)12-6-2-3-8-4-5-9(10)13-8/h2-5H,6H2,1H3/b3-2+
InChIKey DKFBBJAEZMXZHD-NSCUHMNNSA-N
Literature Reference DOI 10.1021/ol203013p
Molecular Weight 261.133 g/mol
SMILES c1c(sc(c1)Br)\C=C\COC(C)=O
SPLASH splash10-0229-2970000000-492630936fea8d2f489a
Source of Spectrum A1-14-226/SM4-3f
Wiley ID 1749962