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S-tert-Butyl (2R*,3R*)-2-Benzyloxy-3-hydroxy-6-methyl-4-heptynethioate
SpectraBase Compound ID LNMfBhVIGpp
InChI InChI=1S/C19H26O3S/c1-14(2)11-12-16(20)17(18(21)23-19(3,4)5)22-13-15-9-7-6-8-10-15/h6-10,14,16-17,20H,13H2,1-5H3/t16-,17-/m1/s1
InChIKey KHBYRPNNHGHQDI-IAGOWNOFSA-N
Mol Weight 334.47 g/mol
Molecular Formula C19H26O3S
Exact Mass 334.160266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Wlnw4Y0asc
Name S-tert-Butyl (2R*,3R*)-2-Benzyloxy-3-hydroxy-6-methyl-4-heptynethioate
Alternate Name(s) S-(tert-butyl) (2R,3R)-2-(benzyloxy)-3-hydroxy-6-methyl-4-heptynethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O3S
InChI InChI=1S/C19H26O3S/c1-14(2)11-12-16(20)17(18(21)23-19(3,4)5)22-13-15-9-7-6-8-10-15/h6-10,14,16-17,20H,13H2,1-5H3/t16-,17-/m1/s1
InChIKey KHBYRPNNHGHQDI-IAGOWNOFSA-N
Molecular Weight 334.474 g/mol
SMILES O[C@](C#CC(C)C)([C@](C(SC(C)(C)C)=O)(OCc1ccccc1)[H])[H]
SPLASH splash10-000i-0090000000-b18b74335b830452cb77
Source of Spectrum J-60-5916-34
Wiley ID 1330961