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FRAJOPQPLCNTSF-UHFFFAOYSA-N

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FRAJOPQPLCNTSF-UHFFFAOYSA-N
SpectraBase Compound ID FtfubAWhnrg
InChI InChI=1S/C48H76N2O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-37-49-45-33-29-30-34-46(45)55-47(49)36-35-42-39-44(50(52)53)40-43(48(42)51)41-54-38-32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-30,33-36,39-40H,3-28,31-32,37-38,41H2,1-2H3
InChIKey FRAJOPQPLCNTSF-UHFFFAOYSA-N
Mol Weight 777.2 g/mol
Molecular Formula C48H76N2O4S
Exact Mass 776.55258 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BgBOMtq8Ul7
Name FRAJOPQPLCNTSF-UHFFFAOYSA-N
Compound Number 8
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C48H76N2O4S
InChI InChI=1S/C48H76N2O4S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-31-37-49-45-33-29-30-34-46(45)55-47(49)36-35-42-39-44(50(52)53)40-43(48(42)51)41-54-38-32-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h29-30,33-36,39-40H,3-28,31-32,37-38,41H2,1-2H3
InChIKey FRAJOPQPLCNTSF-UHFFFAOYSA-N
Literature Reference Author M.MAGUET,M.LEBACCON,Y.POIRIER,R.GUGLIELMETTI
Literature Reference Citation CAN.J.CHEM.,60,2644(1982)
Literature Reference DOI 10.1139/v82-380
Molecular Weight 777.202 g/mol
Solvent CDCl3
Source File Reference UWCS7170