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2-S-HYDROXYISOBROMOSPHAEROL
SpectraBase Compound ID KGD08qr7s5o
InChI InChI=1S/C20H32Br2O2/c1-12(2)14-9-13(23)10-15-17-18(3,7-8-20(14,15)11-21)16(22)5-6-19(17,4)24/h10,12-14,16-17,23-24H,5-9,11H2,1-4H3/t13-,14-,16-,17-,18+,19+,20-/m0/s1
InChIKey YZPAZPZQHZGBFE-FSUCBALESA-N
Mol Weight 464.3 g/mol
Molecular Formula C20H32Br2O2
Exact Mass 462.076906 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4aFu5Cf0fDH
Name 2-S-HYDROXYISOBROMOSPHAEROL
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H32Br2O2
InChI InChI=1S/C20H32Br2O2/c1-12(2)14-9-13(23)10-15-17-18(3,7-8-20(14,15)11-21)16(22)5-6-19(17,4)24/h10,12-14,16-17,23-24H,5-9,11H2,1-4H3/t13-,14-,16-,17-,18+,19+,20-/m0/s1
InChIKey YZPAZPZQHZGBFE-FSUCBALESA-N
Literature Reference Author V.SMYRNIOTOPOULOS,C.VAGIAS,M.M.RAHMAN,S.GIBBONS,V.ROUSSIS
Literature Reference Citation J.NAT.PROD.,71,1386(2008)
Literature Reference DOI 10.1021/np8001817
Molecular Weight 464.281 g/mol
Sample ID 28464
Solvent CDCl3