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2-Acetoxy-3-(p-toluenesulfonyl)-1,3-butadiene
SpectraBase Compound ID 1K7IwElmTep
InChI InChI=1S/C13H14O4S/c1-9-5-7-13(8-6-9)18(15,16)11(3)10(2)17-12(4)14/h5-8H,2-3H2,1,4H3
InChIKey ICEQGZAHZJIWMF-UHFFFAOYSA-N
Mol Weight 266.31 g/mol
Molecular Formula C13H14O4S
Exact Mass 266.06128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 33Fq7eKFE94
Name 2-Acetoxy-3-(p-toluenesulfonyl)-1,3-butadiene
Alternate Name(s) 1-Methylene-2-[(4-methylphenyl)sulfonyl]-2-propenyl acetate
CAS Registry Number 127381-27-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14O4S
InChI InChI=1S/C13H14O4S/c1-9-5-7-13(8-6-9)18(15,16)11(3)10(2)17-12(4)14/h5-8H,2-3H2,1,4H3
InChIKey ICEQGZAHZJIWMF-UHFFFAOYSA-N
Molecular Weight 266.311 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(C(OC(=O)C)=C)=C
SPLASH splash10-0006-6910000000-c0b607f20d80115e3c92
Source of Spectrum J-55-4601-5
Wiley ID 1269664