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Benzyl (E)-5-(2-butyl-1,3-dithian-2-yl)-pent-2-enoate
SpectraBase Compound ID GZ510oK2x4a
InChI InChI=1S/C20H28O2S2/c1-2-3-13-20(23-15-9-16-24-20)14-8-7-12-19(21)22-17-18-10-5-4-6-11-18/h4-7,10-12H,2-3,8-9,13-17H2,1H3/b12-7+
InChIKey RFWVZCFEPCRSDO-KPKJPENVSA-N
Mol Weight 364.56 g/mol
Molecular Formula C20H28O2S2
Exact Mass 364.153072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2eNUeiKJDeA
Name Benzyl (E)-5-(2-butyl-1,3-dithian-2-yl)-pent-2-enoate
Alternate Name(s) (E)-benzyl 5-(2-butyl-1,3-dithian-2-yl)pent-2-enoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O2S2
InChI InChI=1S/C20H28O2S2/c1-2-3-13-20(23-15-9-16-24-20)14-8-7-12-19(21)22-17-18-10-5-4-6-11-18/h4-7,10-12H,2-3,8-9,13-17H2,1H3/b12-7+
InChIKey RFWVZCFEPCRSDO-KPKJPENVSA-N
Literature Reference DOI 10.1002/cjoc.200690221
Molecular Weight 364.562 g/mol
SMILES C1SC(CCCC)(SCC1)CC\C=C\C(OCc1ccccc1)=O
SPLASH splash10-05bf-8954000000-73e03c3a0794b44cbb57
Source of Spectrum CJC-24-1185-18
Wiley ID 1774343