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ETHYL-2-(4-CHLORO-(2-ETHOXYCARBONYLAMINOBENZOYL)-METHYLSULFONYLACETATE;KETO-FORM
SpectraBase Compound ID CTO9smcetrp
InChI InChI=1S/C15H18ClNO7S/c1-4-23-14(19)13(25(3,21)22)12(18)10-7-6-9(16)8-11(10)17-15(20)24-5-2/h6-8,13H,4-5H2,1-3H3,(H,17,20)
InChIKey LEQNNRHMNKNGKP-UHFFFAOYSA-N
Mol Weight 391.82 g/mol
Molecular Formula C15H18ClNO7S
Exact Mass 391.049251 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F6XSwajE8qr
Name ETHYL-2-(4-CHLORO-(2-ETHOXYCARBONYLAMINOBENZOYL)-METHYLSULFONYLACETATE;KETO-FORM
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H18ClNO7S
InChI InChI=1S/C15H18ClNO7S/c1-4-23-14(19)13(25(3,21)22)12(18)10-7-6-9(16)8-11(10)17-15(20)24-5-2/h6-8,13H,4-5H2,1-3H3,(H,17,20)
InChIKey LEQNNRHMNKNGKP-UHFFFAOYSA-N
Literature Reference Author C.MITSOS,A.ZOGRAFOS,O.IGGLESSI-MARKOPOULOU
Literature Reference Citation HETEROCYCLES,51,1543(1999)
Literature Reference DOI 10.3987/COM-99-8508
Molecular Weight 391.823 g/mol
Solvent CDCl3
Source File Reference UWVP7576