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Methyl (1'-benzenesulfonyl-1'-carbomethoxy-5'-pentyl)-6-acetoxy-7-octenoate

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Methyl (1'-benzenesulfonyl-1'-carbomethoxy-5'-pentyl)-6-acetoxy-7-octenoate
SpectraBase Compound ID K7BbtjjweAD
InChI InChI=1S/C23H32O8S/c1-4-19(31-18(2)24)12-8-9-16-22(25)30-17-11-10-15-21(23(26)29-3)32(27,28)20-13-6-5-7-14-20/h4-7,13-14,19,21H,1,8-12,15-17H2,2-3H3
InChIKey BEFSSKMMPJWAOH-UHFFFAOYSA-N
Mol Weight 468.6 g/mol
Molecular Formula C23H32O8S
Exact Mass 468.181789 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FrX7UkhuLmK
Name Methyl (1'-benzenesulfonyl-1'-carbomethoxy-5'-pentyl)-6-acetoxy-7-octenoate
CAS Registry Number 63294-77-9
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C23H32O8S
InChI InChI=1S/C23H32O8S/c1-4-19(31-18(2)24)12-8-9-16-22(25)30-17-11-10-15-21(23(26)29-3)32(27,28)20-13-6-5-7-14-20/h4-7,13-14,19,21H,1,8-12,15-17H2,2-3H3
InChIKey BEFSSKMMPJWAOH-UHFFFAOYSA-N
Instrument Name Jeol FX-60
Literature Reference B.M. Trost, T.R. Verhoeven, J. Am. Chem. Soc. 102, 4743 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3