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1,4-Dichloro-3-(phenylseleno)-2-buten-2-ol p-Toluenesulfonate
SpectraBase Compound ID DYH3sxTgP32
InChI InChI=1S/C17H16Cl2O3SSe/c1-13-7-9-14(10-8-13)23(20,21)22-16(11-18)17(12-19)24-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3/b17-16-
InChIKey BCSWLXPASHBZSB-MSUUIHNZSA-N
Mol Weight 450.25 g/mol
Molecular Formula C17H16Cl2O3SSe
Exact Mass 449.936243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C0tbEfCSFTL
Name 1,4-Dichloro-3-(phenylseleno)-2-buten-2-ol p-Toluenesulfonate
Alternate Name(s) (1Z)-3-chloro-1-(chloromethyl)-2-(phenylselanyl)-1-propenyl 4-methylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16Cl2O3SSe
InChI InChI=1S/C17H16Cl2O3SSe/c1-13-7-9-14(10-8-13)23(20,21)22-16(11-18)17(12-19)24-15-5-3-2-4-6-15/h2-10H,11-12H2,1H3/b17-16-
InChIKey BCSWLXPASHBZSB-MSUUIHNZSA-N
Molecular Weight 450.250 g/mol
SMILES c1([Se]\C(=C\(OS(c2ccc(cc2)C)(=O)=O)CCl)CCl)ccccc1
SPLASH splash10-066u-9310000000-c6fcc5ac2f9f0db9305a
Source of Spectrum J-56-2785-10
Wiley ID 1387553