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(1E,3E)-2-chloranyl-3-phenylsulfanyl-cycloocta-1,3-diene
SpectraBase Compound ID 493dWXEn4yE
InChI InChI=1S/C14H15ClS/c15-13-10-6-1-2-7-11-14(13)16-12-8-4-3-5-9-12/h3-5,8-11H,1-2,6-7H2/b13-10+,14-11+
InChIKey KUBKXFBAWGFTHM-IFQMDVHZSA-N
Mol Weight 250.79 g/mol
Molecular Formula C14H15ClS
Exact Mass 250.058299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID s6JQVSdqy
Name (1E,3E)-2-chloranyl-3-phenylsulfanyl-cycloocta-1,3-diene
Alternate Name(s) (1E,3E)-2-chloro-3-(phenylthio)cycloocta-1,3-diene (1E,3E)-2-chloro-3-phenylsulfanyl-cycloocta-1,3-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H15ClS
InChI InChI=1S/C14H15ClS/c15-13-10-6-1-2-7-11-14(13)16-12-8-4-3-5-9-12/h3-5,8-11H,1-2,6-7H2/b13-10+,14-11+
InChIKey KUBKXFBAWGFTHM-IFQMDVHZSA-N
Molecular Weight 250.787 g/mol
SMILES C1\C=C/(\C(=C/CCC1)Sc1ccccc1)Cl
SPLASH splash10-0n4i-2950000000-f3239bcfd3e6e09253ca
Source of Spectrum SK-22-2050-11
Wiley ID 852037