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Iso-methyl-19,20-dihydro-20-(methylthio)-vallesiachotamate

View entire compound with spectra: 4 NMR

Iso-methyl-19,20-dihydro-20-(methylthio)-vallesiachotamate
SpectraBase Compound ID 2vmMtjcf2vy
InChI InChI=1S/C23H28N2O4S/c1-5-23(30-4,22(27)29-3)17-12-19-20-15(14-8-6-7-9-18(14)24-20)10-11-25(19)13-16(17)21(26)28-2/h6-9,13,17,19,24H,5,10-12H2,1-4H3
InChIKey ALHIXNJTTYYBOQ-UHFFFAOYSA-N
Mol Weight 428.55 g/mol
Molecular Formula C23H28N2O4S
Exact Mass 428.176979 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ADFd9ZBp2eq
Name Iso-methyl-19,20-dihydro-20-(methylthio)-vallesiachotamate
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C23H28N2O4S
InChI InChI=1S/C23H28N2O4S/c1-5-23(30-4,22(27)29-3)17-12-19-20-15(14-8-6-7-9-18(14)24-20)10-11-25(19)13-16(17)21(26)28-2/h6-9,13,17,19,24H,5,10-12H2,1-4H3
InChIKey ALHIXNJTTYYBOQ-UHFFFAOYSA-N
Instrument Name SF = 300 MHz
Literature Reference J. Org. Chem. 53, 2274 (1988).
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3