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Dithia-(3.3)ortho-para-cyclophane

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Dithia-(3.3)ortho-para-cyclophane
SpectraBase Compound ID EoJZruht2Qo
InChI InChI=1S/C16H16S2/c1-2-4-16-12-18-10-14-7-5-13(6-8-14)9-17-11-15(16)3-1/h1-8H,9-12H2
InChIKey PRMBUGOQNSCWKQ-UHFFFAOYSA-N
Mol Weight 272.42 g/mol
Molecular Formula C16H16S2
Exact Mass 272.069343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FpH5NyqQSQi
Name Dithia-(3.3)ortho-para-cyclophane
CAS Registry Number 118724-09-7
Comments ASSIGNED BY 2D C,H-COSY AND -COLOC SOLVENT:CD2CL2/CDCL3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H16S2
InChI InChI=1S/C16H16S2/c1-2-4-16-12-18-10-14-7-5-13(6-8-14)9-17-11-15(16)3-1/h1-8H,9-12H2
InChIKey PRMBUGOQNSCWKQ-UHFFFAOYSA-N
Instrument Name Bruker AM-400
NMR Standard CD2Cl2
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2