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2-[4'-(phenylsulfonyl)but-2'-ynyl]cyclopentanone
SpectraBase Compound ID HiPOitkj30L
InChI InChI=1S/C15H16O3S/c16-15-11-6-8-13(15)7-4-5-12-19(17,18)14-9-2-1-3-10-14/h1-3,9-10,13H,6-8,11-12H2
InChIKey VXHFCLLJUHMNKG-UHFFFAOYSA-N
Mol Weight 276.35 g/mol
Molecular Formula C15H16O3S
Exact Mass 276.082016 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6iwTrTTyf0p
Name 2-[4'-(PHENYLSULFONYL)-BUT-2'-YNYL]-CYClOPENTANONE
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H16O3S
InChI InChI=1S/C15H16O3S/c16-15-11-6-8-13(15)7-4-5-12-19(17,18)14-9-2-1-3-10-14/h1-3,9-10,13H,6-8,11-12H2
InChIKey VXHFCLLJUHMNKG-UHFFFAOYSA-N
Literature Reference Author W.A.LOUGHLIN,R.K.HAYNES,S.SITPASEUTH
Literature Reference Citation AUSTR.J.CHEM.,48,491(1995)
Literature Reference DOI 10.1071/CH9950491
Molecular Weight 276.350 g/mol
Solvent CDCl3
Source File Reference UWRK3099