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2-(3-Chloropropyl)-1-phenylthiopenta- 1(Z),4-diene
SpectraBase Compound ID EDsSsyZCU98
InChI InChI=1S/C14H17ClS/c1-2-7-13(8-6-11-15)12-16-14-9-4-3-5-10-14/h2-5,9-10,12H,1,6-8,11H2/b13-12+
InChIKey SQYGONGMGQHYPN-OUKQBFOZSA-N
Mol Weight 252.8 g/mol
Molecular Formula C14H17ClS
Exact Mass 252.073949 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5PuLES5y62
Name 2-(3-Chloropropyl)-1-phenylthiopenta- 1(Z),4-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClS
InChI InChI=1S/C14H17ClS/c1-2-7-13(8-6-11-15)12-16-14-9-4-3-5-10-14/h2-5,9-10,12H,1,6-8,11H2/b13-12+
InChIKey SQYGONGMGQHYPN-OUKQBFOZSA-N
Literature Reference DOI 10.1021/ol062686r
Molecular Weight 252.803 g/mol
SMILES c1(ccccc1)S\C=C/(CC=C)CCCCl
SPLASH splash10-004i-9730000000-5bbc5a0d2f23e9e6e16b
Source of Spectrum A1-9-263/SMS3-4da
Synonyms (Z)-(2-(3-chloropropyl)penta-1,4-dien-1-yl)(phenyl)sulfane
Wiley ID 1757771