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3-(1'-GERMA-5'-AZA-2',8',9'-TRITHIABICYCLOUNDECYL)-3-PHENYL-PROPANOIC-ACID;ISOMER-#1
SpectraBase Compound ID t4WfAcgN79
InChI InChI=1S/C15H21GeNO2S3/c18-15(19)12-14(13-4-2-1-3-5-13)16-20-9-6-17(7-10-21-16)8-11-22-16/h1-5,14H,6-12H2,(H,18,19)
InChIKey GVNPHLBFBAFMCD-UHFFFAOYSA-N
Mol Weight 416.15 g/mol
Molecular Formula C15H21GeNO2S3
Exact Mass 416.99462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 77Pv9Kwyq7F
Name 3-(1'-GERMA-5'-AZA-2',8',9'-TRITHIABICYCLOUNDECYL)-3-PHENYL-PROPANOIC-ACID;ISOMER-#1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C15H21GeNO2S3
InChI InChI=1S/C15H21GeNO2S3/c18-15(19)12-14(13-4-2-1-3-5-13)16-20-9-6-17(7-10-21-16)8-11-22-16/h1-5,14H,6-12H2,(H,18,19)
InChIKey GVNPHLBFBAFMCD-UHFFFAOYSA-N
Literature Reference Author N.KAKIMOTO,K.SATO,M.MATSUI,T.TAKADA,M.AKIBA
Literature Reference Citation HETEROCYCLES,24,3047(1986)
Literature Reference DOI 10.3987/R-1986-11-3047
Molecular Weight 416.107 g/mol
Solvent DMSO-D6
Source File Reference UWED12394