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Methyl-(2sr, 7RS)-2-(2'-nitrophenylthio)-4-oxa-5-oxotricyclo-[4.4.0.0(3,8)]-decan-7-carboxylate
SpectraBase Compound ID IxcZ2WFDRx7
InChI InChI=1S/C17H17NO6S/c1-23-16(19)12-8-6-7-9-13(12)17(20)24-14(8)15(9)25-11-5-3-2-4-10(11)18(21)22/h2-5,8-9,12-15H,6-7H2,1H3
InChIKey JUMMXVIJYAKRQC-UHFFFAOYSA-N
Mol Weight 363.38 g/mol
Molecular Formula C17H17NO6S
Exact Mass 363.077658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HbFpvXUAkG1
Name Methyl-(2sr, 7RS)-2-(2'-nitrophenylthio)-4-oxa-5-oxotricyclo-[4.4.0.0(3,8)]-decan-7-carboxylate
CAS Registry Number 72444-07-6
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C17H17NO6S
InChI InChI=1S/C17H17NO6S/c1-23-16(19)12-8-6-7-9-13(12)17(20)24-14(8)15(9)25-11-5-3-2-4-10(11)18(21)22/h2-5,8-9,12-15H,6-7H2,1H3
InChIKey JUMMXVIJYAKRQC-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