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Methyl-(2sr, 7RS)-2-(2',4'-dinitrophenylthio)-4-oxa-5-oxotricyclo-[4.4.0.0(3,8)]-decan-7-carboxylate
SpectraBase Compound ID w6NX7tLv4B
InChI InChI=1S/C17H16N2O8S/c1-26-16(20)12-8-3-4-9-13(12)17(21)27-14(8)15(9)28-11-5-2-7(18(22)23)6-10(11)19(24)25/h2,5-6,8-9,12-15H,3-4H2,1H3
InChIKey LPJAVLGZFWEWAB-UHFFFAOYSA-N
Mol Weight 408.38 g/mol
Molecular Formula C17H16N2O8S
Exact Mass 408.062737 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID E47GWEvpMAh
Name Methyl-(2sr, 7RS)-2-(2',4'-dinitrophenylthio)-4-oxa-5-oxotricyclo-[4.4.0.0(3,8)]-decan-7-carboxylate
CAS Registry Number 72453-31-7
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H16N2O8S
InChI InChI=1S/C17H16N2O8S/c1-26-16(20)12-8-3-4-9-13(12)17(21)27-14(8)15(9)28-11-5-2-7(18(22)23)6-10(11)19(24)25/h2,5-6,8-9,12-15H,3-4H2,1H3
InChIKey LPJAVLGZFWEWAB-UHFFFAOYSA-N
Instrument Name SF = 080 MHz
Literature Reference J. Org. Chem. 45, 839 (1980).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3