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3-Cyano-4-methyl-2-oxo-2H-chromen-7-yl 4-methoxybenzenesulfonate
SpectraBase Compound ID 53y2ROzvuwV
InChI InChI=1S/C18H13NO6S/c1-11-15-8-5-13(9-17(15)24-18(20)16(11)10-19)25-26(21,22)14-6-3-12(23-2)4-7-14/h3-9H,1-2H3
InChIKey CZGIQUZTDVBVGJ-UHFFFAOYSA-N
Mol Weight 371.36 g/mol
Molecular Formula C18H13NO6S
Exact Mass 371.046358 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Hvj04R8UzK
Name 3-Cyano-4-methyl-2-oxo-2H-chromen-7-yl 4-methoxybenzenesulfonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13NO6S
InChI InChI=1S/C18H13NO6S/c1-11-15-8-5-13(9-17(15)24-18(20)16(11)10-19)25-26(21,22)14-6-3-12(23-2)4-7-14/h3-9H,1-2H3
InChIKey CZGIQUZTDVBVGJ-UHFFFAOYSA-N
Molecular Weight 371.363 g/mol
SMILES c1(ccc(cc1)OC)S(=O)(=O)Oc1ccc2C(=C(C(Oc2c1)=O)C#N)C
SPLASH splash10-00di-3900000000-74689441f9e682e60aff
Source of Spectrum Uzma Salar, et al. European Journal of Medicinal Chemistry, V.131, 2017, P.29-47
Wiley ID 1816415