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Ethyl-4-bromo-3,4-dimethyl-3-hydroxy-2-(phenylthio)-pentanoate
SpectraBase Compound ID 2JHINTRr6hz
InChI InChI=1S/C15H21BrO3S/c1-5-19-13(17)12(15(4,18)14(2,3)16)20-11-9-7-6-8-10-11/h6-10,12,18H,5H2,1-4H3
InChIKey YZAMSULZTBILAM-UHFFFAOYSA-N
Mol Weight 361.29 g/mol
Molecular Formula C15H21BrO3S
Exact Mass 360.039479 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CdMjLSX4r1y
Name ETHYL-4-BROMO-3,4-DIMETHYL-3-HYDROXY-2-(PHENYLTHIO)-PENTANOATE
CAS Registry Number 77320-64-0
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H21BrO3S
InChI InChI=1S/C15H21BrO3S/c1-5-19-13(17)12(15(4,18)14(2,3)16)20-11-9-7-6-8-10-11/h6-10,12,18H,5H2,1-4H3
InChIKey YZAMSULZTBILAM-UHFFFAOYSA-N
Literature Reference Author T.SAKAI,T.KATAYAMA,A.TAKEDA
Literature Reference Citation J.ORG.CHEM.,46,2924(1981)
Literature Reference DOI 10.1021/jo00327a017
Molecular Weight 361.294 g/mol
Solvent CDCl3
Source File Reference UNIW20567