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5-Phenylthio-4-propyl-octa-1,4(Z)-diene
SpectraBase Compound ID HWqyOwPlJho
InChI InChI=1S/C17H24S/c1-4-10-15(11-5-2)17(12-6-3)18-16-13-8-7-9-14-16/h4,7-9,13-14H,1,5-6,10-12H2,2-3H3/b17-15+
InChIKey JCWWAGQEVPRFFD-BMRADRMJSA-N
Mol Weight 260.44 g/mol
Molecular Formula C17H24S
Exact Mass 260.159872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID eCfgZwnd4M
Name 5-Phenylthio-4-propyl-octa-1,4(Z)-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24S
InChI InChI=1S/C17H24S/c1-4-10-15(11-5-2)17(12-6-3)18-16-13-8-7-9-14-16/h4,7-9,13-14H,1,5-6,10-12H2,2-3H3/b17-15+
InChIKey JCWWAGQEVPRFFD-BMRADRMJSA-N
Literature Reference DOI 10.1021/ol062686r
Molecular Weight 260.439 g/mol
SMILES C(\C(=C\(CC=C)CCC)Sc1ccccc1)CC
SPLASH splash10-053r-4920000000-8a959fec3d37060993e8
Source of Spectrum A1-9-263/SMS6-3pa
Synonyms (Z)-phenyl(5-propylocta-4,7-dien-4-yl)sulfane
Wiley ID 1757762