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1-(cis-3a,4,5,6,7,7a-Hexahydro-benzothiazol-2-yl)-2-phenyl-acetylene

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1-(cis-3a,4,5,6,7,7a-Hexahydro-benzothiazol-2-yl)-2-phenyl-acetylene
SpectraBase Compound ID 1ldIlS3V0mJ
InChI InChI=1S/C15H15NS/c1-2-6-12(7-3-1)10-11-15-16-13-8-4-5-9-14(13)17-15/h1-3,6-7,13-14H,4-5,8-9H2
InChIKey IRUNLEFCSJWIPH-UHFFFAOYSA-N
Mol Weight 241.35 g/mol
Molecular Formula C15H15NS
Exact Mass 241.092521 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 11zGQIu3krM
Name 1-(cis-3a,4,5,6,7,7a-Hexahydro-benzothiazol-2-yl)-2-phenyl-acetylene
CAS Registry Number 77469-24-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H15NS
InChI InChI=1S/C15H15NS/c1-2-6-12(7-3-1)10-11-15-16-13-8-4-5-9-14(13)17-15/h1-3,6-7,13-14H,4-5,8-9H2
InChIKey IRUNLEFCSJWIPH-UHFFFAOYSA-N
Literature Reference R.C. Cambie, D. Chambers, P.S. Rutledge, J. Chem. Soc. Perkin I 40 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported