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1,3-HEXADIYNYL METHYL SULFIDE
SpectraBase Compound ID Hmga5W5k9rJ
InChI InChI=1S/C7H8S/c1-3-4-5-6-7-8-2/h3H2,1-2H3
InChIKey KVRWEWQSNSBHHI-UHFFFAOYSA-N
Mol Weight 124.2 g/mol
Molecular Formula C7H8S
Exact Mass 124.034671 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ELRAZvb2qyA
Name 1-Methylthio-1,3-hexadiyne
CAS Registry Number 58890-30-5
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H8S
InChI InChI=1S/C7H8S/c1-3-4-5-6-7-8-2/h3H2,1-2H3
InChIKey KVRWEWQSNSBHHI-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference G.A. Kalabin, A.G. Proidakov, S.I. Radchenko, Zh. Org. Khim. 16, 512 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3