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Methyl-(2sr, 7RS)-2-(2'-methyl-4'-nitrophenylthio)-4-oxa-5-oxotricyclo-[4.4.0.0(3,8)]-decan-7-carboxylate
SpectraBase Compound ID IToHuaa2glA
InChI InChI=1S/C18H19NO6S/c1-8-7-9(19(22)23)3-6-12(8)26-16-11-5-4-10-13(17(20)24-2)14(11)18(21)25-15(10)16/h3,6-7,10-11,13-16H,4-5H2,1-2H3
InChIKey UAICPKALVGPQBB-UHFFFAOYSA-N
Mol Weight 377.41 g/mol
Molecular Formula C18H19NO6S
Exact Mass 377.093309 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cu9BeWCVf2P
Name Methyl-(2sr, 7RS)-2-(2'-methyl-4'-nitrophenylthio)-4-oxa-5-oxotricyclo-[4.4.0.0(3,8)]-decan-7-carboxylate
CAS Registry Number 72453-32-8
Comments broad-band decoupling (BB)
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C18H19NO6S
InChI InChI=1S/C18H19NO6S/c1-8-7-9(19(22)23)3-6-12(8)26-16-11-5-4-10-13(17(20)24-2)14(11)18(21)25-15(10)16/h3,6-7,10-11,13-16H,4-5H2,1-2H3
InChIKey UAICPKALVGPQBB-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