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2-Chloro-3-(p-toluenesulfonyl)-1,3-butadiene
SpectraBase Compound ID qwCQkgaXOV
InChI InChI=1S/C11H11ClO2S/c1-8-4-6-11(7-5-8)15(13,14)10(3)9(2)12/h4-7H,2-3H2,1H3
InChIKey XCQDTBUIYPCKGI-UHFFFAOYSA-N
Mol Weight 242.72 g/mol
Molecular Formula C11H11ClO2S
Exact Mass 242.016828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9g0UWOLttbt
Name 2-Chloro-3-(p-toluenesulfonyl)-1,3-butadiene
Alternate Name(s) 1-[(2-chloro-1-methylene-2-propenyl)sulfonyl]-4-methylbenzene 2-Chloro-1-methylene-2-propenyl 4-methylphenyl sulfone
CAS Registry Number 127381-28-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11ClO2S
InChI InChI=1S/C11H11ClO2S/c1-8-4-6-11(7-5-8)15(13,14)10(3)9(2)12/h4-7H,2-3H2,1H3
InChIKey XCQDTBUIYPCKGI-UHFFFAOYSA-N
Molecular Weight 242.720 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(C(=C)Cl)=C
SPLASH splash10-0006-5900000000-d7b62670b856cb301cd0
Source of Spectrum J-55-4601-5
Wiley ID 1244636