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2-octyl-m-dithiane-2-carboxylic acid, ethyl ester
SpectraBase Compound ID GoBP9BrPcHq
InChI InChI=1S/C15H28O2S2/c1-3-5-6-7-8-9-11-15(14(16)17-4-2)18-12-10-13-19-15/h3-13H2,1-2H3
InChIKey KXDVSIHGSSLEGI-UHFFFAOYSA-N
Mol Weight 304.51 g/mol
Molecular Formula C15H28O2S2
Exact Mass 304.153072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1vhplg6ZzpG
Name 1,3-Dithiane-2-carboxylic acid, 2-octyl-, ethyl ester
CAS Registry Number 74327-19-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H28O2S2
InChI InChI=1S/C15H28O2S2/c1-3-5-6-7-8-9-11-15(14(16)17-4-2)18-12-10-13-19-15/h3-13H2,1-2H3
InChIKey KXDVSIHGSSLEGI-UHFFFAOYSA-N
Molecular Weight 304.507 g/mol
SMILES C1(C(=O)OCC)(SCCCS1)CCCCCCCC
SPLASH splash10-053r-9130000000-6382bef20e835f1ba969
Source of Spectrum I-60-2827-0
Synonyms 2-Ethoxycarbonyl-2-octyl-1,3-dithiane Ethyl 2-octyl-1,3-dithiane-2-carboxylate
Wiley ID 1306246