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UAGSXFDCYJYDJK-UHFFFAOYSA-N
SpectraBase Compound ID G3sPHqsLWgz
InChI InChI=1S/C31H28N4O4S/c36-28(32-18-20-10-4-1-5-11-20)25-29(37)35-26(23(19-40-30(25)35)24-16-17-33-34-24)31(38)39-27(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,24-25,27,30H,16-19H2,(H,32,36)
InChIKey UAGSXFDCYJYDJK-UHFFFAOYSA-N
Mol Weight 552.65 g/mol
Molecular Formula C31H28N4O4S
Exact Mass 552.183127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID wk1owkouvx
Name UAGSXFDCYJYDJK-UHFFFAOYSA-N
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H28N4O4S
InChI InChI=1S/C31H28N4O4S/c36-28(32-18-20-10-4-1-5-11-20)25-29(37)35-26(23(19-40-30(25)35)24-16-17-33-34-24)31(38)39-27(21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-15,24-25,27,30H,16-19H2,(H,32,36)
InChIKey UAGSXFDCYJYDJK-UHFFFAOYSA-N
Literature Reference Author J.PITLIK,I.MISKOLCZI,K.E.KOEVER,C.J.JASZBERENYI,F.SZTARICSKA I
Literature Reference Citation TETRAH.LETT.,30,2005(1989)
Literature Reference DOI 10.1016/S0040-4039(00)99636-9
Molecular Weight 552.648 g/mol
Solvent DMSO-D6
Source File Reference UWCS9999