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3-Chloro-4-methyl-2-oxo-2H-chromen-7-yl ethanesulfonate
SpectraBase Compound ID CmGuU5iYYNw
InChI InChI=1S/C12H11ClO5S/c1-3-19(15,16)18-8-4-5-9-7(2)11(13)12(14)17-10(9)6-8/h4-6H,3H2,1-2H3
InChIKey JLGPAIMHGHXMTL-UHFFFAOYSA-N
Mol Weight 302.73 g/mol
Molecular Formula C12H11ClO5S
Exact Mass 302.001572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7YeZfmzmkSf
Name 3-Chloro-4-methyl-2-oxo-2H-chromen-7-yl ethanesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H11ClO5S
InChI InChI=1S/C12H11ClO5S/c1-3-19(15,16)18-8-4-5-9-7(2)11(13)12(14)17-10(9)6-8/h4-6H,3H2,1-2H3
InChIKey JLGPAIMHGHXMTL-UHFFFAOYSA-N
Molecular Weight 302.728 g/mol
SMILES C(C)S(=O)(=O)Oc1ccc2C(=C(C(Oc2c1)=O)Cl)C
SPLASH splash10-0ik9-3894000000-8da92f7bce93db7fe4f2
Source of Spectrum Uzma Salar, et al. European Journal of Medicinal Chemistry, V.131, 2017, P.29-47
Wiley ID 1816413