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S-tert-Butyl (2R*,3R*)-2-Butyl-3-hydroxy-4-pentenethioate
SpectraBase Compound ID 6OcnxNEgeQR
InChI InChI=1S/C13H24O2S/c1-6-8-9-10(11(14)7-2)12(15)16-13(3,4)5/h7,10-11,14H,2,6,8-9H2,1,3-5H3/t10-,11-/m1/s1
InChIKey KYQMNTYLRUMIJV-GHMZBOCLSA-N
Mol Weight 244.39 g/mol
Molecular Formula C13H24O2S
Exact Mass 244.149701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2IKpHu9CCKu
Name S-tert-Butyl (2R*,3R*)-2-Butyl-3-hydroxy-4-pentenethioate
Alternate Name(s) S-(tert-butyl) (2R,3R)-2-butyl-3-hydroxy-4-pentenethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H24O2S
InChI InChI=1S/C13H24O2S/c1-6-8-9-10(11(14)7-2)12(15)16-13(3,4)5/h7,10-11,14H,2,6,8-9H2,1,3-5H3/t10-,11-/m1/s1
InChIKey KYQMNTYLRUMIJV-GHMZBOCLSA-N
Molecular Weight 244.393 g/mol
SMILES O[C@@]([C@](C(SC(C)(C)C)=O)(CCCC)[H])(C=C)[H]
SPLASH splash10-0a4i-9700000000-b4c37eaa6d76e5927ada
Source of Spectrum J-58-2951-21
Wiley ID 1246922