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(2S,3R,4R,5S,6R)-S-Phenyl 3,5,7-trihydroxy-2,4,6-trimethyl-thio-heptanoate 5,7-acetonide
SpectraBase Compound ID GGVAu0v1mI4
InChI InChI=1S/C19H28O4S/c1-12-11-22-19(4,5)23-17(12)13(2)16(20)14(3)18(21)24-15-9-7-6-8-10-15/h6-10,12-14,16-17,20H,11H2,1-5H3
InChIKey FTRAXVPZQPTVJM-UHFFFAOYSA-N
Mol Weight 352.49 g/mol
Molecular Formula C19H28O4S
Exact Mass 352.170831 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1nHinQI0XfY
Name (2S,3R,4R,5S,6R)-S-Phenyl 3,5,7-trihydroxy-2,4,6-trimethyl-thio-heptanoate 5,7-acetonide
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C19H28O4S
InChI InChI=1S/C19H28O4S/c1-12-11-22-19(4,5)23-17(12)13(2)16(20)14(3)18(21)24-15-9-7-6-8-10-15/h6-10,12-14,16-17,20H,11H2,1-5H3
InChIKey FTRAXVPZQPTVJM-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference D. Patel, F. Vanmiddlesworth, J. Donaubauer, J. Am. Chem. Soc. 108, 4603 (1986).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3