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KFIHZCBTAOSIEH-KFRZSCGFSA-N

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KFIHZCBTAOSIEH-KFRZSCGFSA-N
SpectraBase Compound ID 4yEkSUd3TE1
InChI InChI=1S/C18H25NO12S/c20-5-9-11(22)12(23)14(25)17(29-9)31-16-10(6-21)30-18(15(26)13(16)24)32-8-3-1-7(2-4-8)19(27)28/h1-4,9-18,20-26H,5-6H2/t9-,10-,11-,12+,13-,14-,15-,16-,17-,18+/m1/s1
InChIKey KFIHZCBTAOSIEH-KFRZSCGFSA-N
Mol Weight 479.45 g/mol
Molecular Formula C18H25NO12S
Exact Mass 479.109746 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CfmLy2ouyce
Name KFIHZCBTAOSIEH-KFRZSCGFSA-N
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H25NO12S
InChI InChI=1S/C18H25NO12S/c20-5-9-11(22)12(23)14(25)17(29-9)31-16-10(6-21)30-18(15(26)13(16)24)32-8-3-1-7(2-4-8)19(27)28/h1-4,9-18,20-26H,5-6H2/t9-,10-,11-,12+,13-,14-,15-,16-,17-,18+/m1/s1
InChIKey KFIHZCBTAOSIEH-KFRZSCGFSA-N
Literature Reference Author J.REMENYIK,C.RAGUNATH,N.RAMASUBBU,G.GYEMANT,A.LIPTAK,L.KANDR A
Literature Reference Citation ORG.LETTERS,5,4895(2003)
Literature Reference DOI 10.1021/ol035999k
Molecular Weight 479.456 g/mol
Sample ID 29411
Solvent D2O