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1-Chloro-2-(phenylseleno)-3-(p-toluenesulfonyl)-1,3-butadiene
SpectraBase Compound ID LLqMzqEUnwr
InChI InChI=1S/C17H15ClO2SSe/c1-13-8-10-15(11-9-13)21(19,20)14(2)17(12-18)22-16-6-4-3-5-7-16/h3-12H,2H2,1H3/b17-12-
InChIKey NWVXJNRQYZLMIQ-ATVHPVEESA-N
Mol Weight 397.79 g/mol
Molecular Formula C17H15ClO2SSe
Exact Mass 397.964651 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LMWOO6Fg0pe
Name 1-Chloro-2-(phenylseleno)-3-(p-toluenesulfonyl)-1,3-butadiene
Alternate Name(s) (2Z)-3-chloro-1-methylene-2-(phenylselanyl)-2-propenyl 4-methylphenyl sulfone 1-{[(2Z)-3-chloro-1-methylene-2-(phenylselanyl)-2-propenyl]sulfonyl}-4-methylbenzene
CAS Registry Number 127381-46-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15ClO2SSe
InChI InChI=1S/C17H15ClO2SSe/c1-13-8-10-15(11-9-13)21(19,20)14(2)17(12-18)22-16-6-4-3-5-7-16/h3-12H,2H2,1H3/b17-12-
InChIKey NWVXJNRQYZLMIQ-ATVHPVEESA-N
Molecular Weight 397.790 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)(\C([Se]c1ccccc1)=C\Cl)=C
SPLASH splash10-0a4l-9531000000-106a1b8939d6bcc9686f
Source of Spectrum J-55-4601-24
Wiley ID 1368181