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(E)-2-Methyl-5-(1-p-tolylhex-1-en-1-yl)-3-tosylfuran
SpectraBase Compound ID BrTIW1Vc3cs
InChI InChI=1S/C25H28O3S/c1-5-6-7-8-23(21-13-9-18(2)10-14-21)24-17-25(20(4)28-24)29(26,27)22-15-11-19(3)12-16-22/h8-17H,5-7H2,1-4H3/b23-8+
InChIKey NCSCRYWAEUIVDL-LIMNOBDPSA-N
Mol Weight 408.56 g/mol
Molecular Formula C25H28O3S
Exact Mass 408.175916 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Du6mo97vzDF
Name (E)-2-Methyl-5-(1-p-tolylhex-1-en-1-yl)-3-tosylfuran
Alternate Name(s) (E)-2-methyl-5-(1-(p-tolyl)hex-1-en-1-yl)-3-tosylfuran
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H28O3S
InChI InChI=1S/C25H28O3S/c1-5-6-7-8-23(21-13-9-18(2)10-14-21)24-17-25(20(4)28-24)29(26,27)22-15-11-19(3)12-16-22/h8-17H,5-7H2,1-4H3/b23-8+
InChIKey NCSCRYWAEUIVDL-LIMNOBDPSA-N
Literature Reference DOI 10.1021/acs.joc.5b01350
Molecular Weight 408.556 g/mol
SMILES c1(oc(c(c1)S(c1ccc(C)cc1)(=O)=O)C)\C(c1ccc(C)cc1)=C\CCCC
SPLASH splash10-05mo-5309600000-3105137e743fe80a1c72
Source of Spectrum J-80-7861-3n
Wiley ID 1801636