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5-Phenylthioundeca-1,4(Z)-diene
SpectraBase Compound ID EG2lntIZh2r
InChI InChI=1S/C17H24S/c1-3-5-7-9-13-16(12-6-4-2)18-17-14-10-8-11-15-17/h4,8,10-12,14-15H,2-3,5-7,9,13H2,1H3/b16-12-
InChIKey WJIBXPXLYJTNID-VBKFSLOCSA-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 145nmFR14j9
Name 5-Phenylthioundeca-1,4(Z)-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24S
InChI InChI=1S/C17H24S/c1-3-5-7-9-13-16(12-6-4-2)18-17-14-10-8-11-15-17/h4,8,10-12,14-15H,2-3,5-7,9,13H2,1H3/b16-12-
InChIKey WJIBXPXLYJTNID-VBKFSLOCSA-N
Literature Reference DOI 10.1021/ol062686r
Molecular Weight 260.439 g/mol
SMILES C(CCCC\C(Sc1ccccc1)=C\CC=C)C
SPLASH splash10-069s-9410000000-4ca4c5ecb63e2712e134
Source of Spectrum A1-9-263/SMS2-3aa
Synonyms (Z)-phenyl(undeca-1,4-dien-5-yl)sulfane
Wiley ID 1757746