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XPNSGRODSQBFKB-KVUDXWIMSA-N

View entire compound with spectra: 1 NMR

XPNSGRODSQBFKB-KVUDXWIMSA-N
SpectraBase Compound ID 2fCMLAbktXK
InChI InChI=1S/C21H34O7S3/c22-17-13(18(23)15-11-29-7-1-20(15)25-3-4-26-20)9-31-10-14(17)19(24)16-12-30-8-2-21(16)27-5-6-28-21/h13-19,22-24H,1-12H2/t13-,14+,15+,16-,17-,18-,19+
InChIKey XPNSGRODSQBFKB-KVUDXWIMSA-N
Mol Weight 494.7 g/mol
Molecular Formula C21H34O7S3
Exact Mass 494.146667 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A15DSIJ5b5x
Name XPNSGRODSQBFKB-KVUDXWIMSA-N
Compound Number S2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H34O7S3
InChI InChI=1S/C21H34O7S3/c22-17-13(18(23)15-11-29-7-1-20(15)25-3-4-26-20)9-31-10-14(17)19(24)16-12-30-8-2-21(16)27-5-6-28-21/h13-19,22-24H,1-12H2/t13-,14+,15+,16-,17-,18-,19+
InChIKey XPNSGRODSQBFKB-KVUDXWIMSA-N
Literature Reference Author D.E.WARD,H.M.GILLIS,O.T.AKINNUSI,M.A.RASHEED,K.SARAVANAN,P.K .SASMAL
Literature Reference Citation ORG.LETTERS,8,2631(2006)
Literature Reference DOI 10.1021/ol060802k
Molecular Weight 494.677 g/mol
Sample ID 58103
Solvent CDCl3