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8-Chloro-5-phenylthioocta-1,4(Z)-diene
SpectraBase Compound ID GGRUmHYqszD
InChI InChI=1S/C14H17ClS/c1-2-3-8-13(11-7-12-15)16-14-9-5-4-6-10-14/h2,4-6,8-10H,1,3,7,11-12H2/b13-8-
InChIKey GHBBDBSXVJEFCX-JYRVWZFOSA-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 ExrQYV9ulK7
Name 8-Chloro-5-phenylthioocta-1,4(Z)-diene
Alternate Name(s) (Z)-(1-chloroocta-4,7-dien-4-yl)(phenyl)sulfane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17ClS
InChI InChI=1S/C14H17ClS/c1-2-3-8-13(11-7-12-15)16-14-9-5-4-6-10-14/h2,4-6,8-10H,1,3,7,11-12H2/b13-8-
InChIKey GHBBDBSXVJEFCX-JYRVWZFOSA-N
Literature Reference DOI 10.1021/ol062686r
Molecular Weight 252.803 g/mol
SMILES C(CCCl)\C(Sc1ccccc1)=C\CC=C
SPLASH splash10-004i-9730000000-03f784896a46ca71a96d
Source of Spectrum A1-9-263/SMS3-3da
Wiley ID 1757750