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2-[(E)-4-(phenylthio)but-3-enyl]-1-cyclopentanone
SpectraBase Compound ID IEhO99kiBQW
InChI InChI=1S/C15H18OS/c16-15-11-6-8-13(15)7-4-5-12-17-14-9-2-1-3-10-14/h1-3,5,9-10,12-13H,4,6-8,11H2/b12-5+
InChIKey BCYKTCFQDXIOTR-LFYBBSHMSA-N
Mol Weight 246.37 g/mol
Molecular Formula C15H18OS
Exact Mass 246.107836 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KI8XsG3ERbC
Name 2-[(E)-4-(phenylthio)but-3-enyl]-1-cyclopentanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H18OS
InChI InChI=1S/C15H18OS/c16-15-11-6-8-13(15)7-4-5-12-17-14-9-2-1-3-10-14/h1-3,5,9-10,12-13H,4,6-8,11H2/b12-5+
InChIKey BCYKTCFQDXIOTR-LFYBBSHMSA-N
Molecular Weight 246.368 g/mol
SMILES C1(=O)C(CCC1)CC\C=C\Sc1ccccc1
SPLASH splash10-01rl-9810000000-09a86f7a3d16483cc588
Source of Spectrum J-59-1443-18
Synonyms 2-[(E)-4-(phenylthio)but-3-enyl]cyclopentanone 2-[(E)-4-phenylsulfanylbut-3-enyl]cyclopentan-1-one 2-[(E)-4-phenylsulfanylbut-3-enyl]cyclopentanone
Wiley ID 1249138