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1-(METHOXYTRITYLTHIO)-8,11,14,17,20,23-HEXAOXA-2-THIAHEXACOS-25-YNE

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1-(METHOXYTRITYLTHIO)-8,11,14,17,20,23-HEXAOXA-2-THIAHEXACOS-25-YNE
SpectraBase Compound ID AKu8PeL6wwl
InChI InChI=1S/C40H54O8S/c1-3-21-42-23-25-44-27-29-46-31-33-48-34-32-47-30-28-45-26-24-43-22-11-6-12-35-49-40(36-13-7-4-8-14-36,37-15-9-5-10-16-37)38-17-19-39(41-2)20-18-38/h1,4-5,7-10,13-20H,6,11-12,21-35H2,2H3
InChIKey KBMRKSLTWMEXOY-UHFFFAOYSA-N
Mol Weight 694.9 g/mol
Molecular Formula C40H54O8S
Exact Mass 694.35394 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6FaJGyypm1v
Name 1-(METHOXYTRITYLTHIO)-8,11,14,17,20,23-HEXAOXA-2-THIAHEXACOS-25-YNE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C40H54O8S
InChI InChI=1S/C40H54O8S/c1-3-21-42-23-25-44-27-29-46-31-33-48-34-32-47-30-28-45-26-24-43-22-11-6-12-35-49-40(36-13-7-4-8-14-36,37-15-9-5-10-16-37)38-17-19-39(41-2)20-18-38/h1,4-5,7-10,13-20H,6,11-12,21-35H2,2H3
InChIKey KBMRKSLTWMEXOY-UHFFFAOYSA-N
Literature Reference Author S.COMBEMALE,J.N.ASSAM-EVOUNG,S.HOUAIDJI,R.BIBI,V.BARRAGAN-MO NTERO
Literature Reference Citation MOLECULES,19,1120(2014)
Literature Reference DOI 10.3390/molecules19011120
Molecular Weight 694.924 g/mol
Solvent CDCl3
Source File Reference UWBT14290