For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
(2S,3R)-S-ethyl 5-(1,3-dithian-2-yl)-3-hydroxy-2-methylpentanethioate
SpectraBase Compound ID Jgs8e4D3jC5
InChI InChI=1S/C12H22O2S3/c1-3-15-12(14)9(2)10(13)5-6-11-16-7-4-8-17-11/h9-11,13H,3-8H2,1-2H3/t9-,10+/m0/s1
InChIKey RZWIPWBBWXQDFA-VHSXEESVSA-N
Mol Weight 294.49 g/mol
Molecular Formula C12H22O2S3
Exact Mass 294.078193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID Kb8hJZVCG6I
Name (2S,3R)-S-ethyl 5-(1,3-dithian-2-yl)-3-hydroxy-2-methylpentanethioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22O2S3
InChI InChI=1S/C12H22O2S3/c1-3-15-12(14)9(2)10(13)5-6-11-16-7-4-8-17-11/h9-11,13H,3-8H2,1-2H3/t9-,10+/m0/s1
InChIKey RZWIPWBBWXQDFA-VHSXEESVSA-N
Literature Reference DOI 10.1002/cjoc.200591561
Molecular Weight 294.486 g/mol
SMILES O[C@@]([C@@](C(SCC)=O)(C)[H])(CCC1SCCCS1)[H]
SPLASH splash10-00m0-0910000000-c0280c3417c970eea8b7
Source of Spectrum CJC-23-1563-2d
Synonyms (2S,3R)-5-(1,3-dithian-2-yl)-3-hydroxy-2-methylpentanethioic acid S-ethyl ester S-ethyl (2S,3R)-5-(1,3-dithian-2-yl)-3-hydroxy-2-methylpentanethioate S-ethyl (2S,3R)-5-(1,3-dithian-2-yl)-3-hydroxy-2-methyl-pentanethioate S-ethyl (2S,3R)-5-(1,3-dithian-2-yl)-2-methyl-3-oxidanyl-pentanethioate
Wiley ID 1774151