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3-Cyano-4-methyl-2-oxo-2H-chromen-7-yl 4-chlorobenzenesulfonate
SpectraBase Compound ID Ajgvg8HBLoq
InChI InChI=1S/C17H10ClNO5S/c1-10-14-7-4-12(8-16(14)23-17(20)15(10)9-19)24-25(21,22)13-5-2-11(18)3-6-13/h2-8H,1H3
InChIKey FIDFOVUHMCYRCF-UHFFFAOYSA-N
Mol Weight 375.78 g/mol
Molecular Formula C17H10ClNO5S
Exact Mass 374.996821 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B4Ip9eTCFVI
Name 3-Cyano-4-methyl-2-oxo-2H-chromen-7-yl 4-chlorobenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H10ClNO5S
InChI InChI=1S/C17H10ClNO5S/c1-10-14-7-4-12(8-16(14)23-17(20)15(10)9-19)24-25(21,22)13-5-2-11(18)3-6-13/h2-8H,1H3
InChIKey FIDFOVUHMCYRCF-UHFFFAOYSA-N
Molecular Weight 375.782 g/mol
SMILES c1(ccc(cc1)Cl)S(=O)(=O)Oc1ccc2C(=C(C(Oc2c1)=O)C#N)C
SPLASH splash10-01t9-2900000000-d516e973f278f93c46c3
Source of Spectrum Uzma Salar, et al. European Journal of Medicinal Chemistry, V.131, 2017, P.29-47
Wiley ID 1816417