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3-Chloro-4-methyl-2-oxo-2H-chromen-7-yl 4-propylbenzenesulfonate
SpectraBase Compound ID BtmZ4RjguhD
InChI InChI=1S/C19H17ClO5S/c1-3-4-13-5-8-15(9-6-13)26(22,23)25-14-7-10-16-12(2)18(20)19(21)24-17(16)11-14/h5-11H,3-4H2,1-2H3
InChIKey VXNNRHJPEAHNPC-UHFFFAOYSA-N
Mol Weight 392.85 g/mol
Molecular Formula C19H17ClO5S
Exact Mass 392.048523 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D9Ktn8GXoBH
Name 3-Chloro-4-methyl-2-oxo-2H-chromen-7-yl 4-propylbenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H17ClO5S
InChI InChI=1S/C19H17ClO5S/c1-3-4-13-5-8-15(9-6-13)26(22,23)25-14-7-10-16-12(2)18(20)19(21)24-17(16)11-14/h5-11H,3-4H2,1-2H3
InChIKey VXNNRHJPEAHNPC-UHFFFAOYSA-N
Molecular Weight 392.853 g/mol
SMILES c1(ccc(cc1)CCC)S(=O)(=O)Oc1ccc2C(=C(C(Oc2c1)=O)Cl)C
SPLASH splash10-0006-5913000000-d0124b8e6121123cecdd
Source of Spectrum Uzma Salar, et al. European Journal of Medicinal Chemistry, V.131, 2017, P.29-47
Wiley ID 1816408