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5,5;20,20-BIS-(ETHYLENEDIOXY)-4,5-SECOPREGN-3-YNE

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5,5;20,20-BIS-(ETHYLENEDIOXY)-4,5-SECOPREGN-3-YNE
SpectraBase Compound ID DfdEt5LjgNM
InChI InChI=1S/C25H38O4/c1-5-6-11-23(3)20-10-12-22(2)19(7-8-21(22)24(4)26-14-15-27-24)18(20)9-13-25(23)28-16-17-29-25/h1,18-21H,6-17H2,2-4H3/t18-,19-,20-,21-,22-,23+/m0/s1
InChIKey OWYFIXIDQRKLMH-RCTKEMKKSA-N
Mol Weight 402.6 g/mol
Molecular Formula C25H38O4
Exact Mass 402.27701 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IK10Dfyozh4
Name 5,5;20,20-BIS-(ETHYLENEDIOXY)-4,5-SECOPREGN-3-YNE
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H38O4
InChI InChI=1S/C25H38O4/c1-5-6-11-23(3)20-10-12-22(2)19(7-8-21(22)24(4)26-14-15-27-24)18(20)9-13-25(23)28-16-17-29-25/h1,18-21H,6-17H2,2-4H3/t18-,19-,20-,21-,22-,23+/m0/s1
InChIKey OWYFIXIDQRKLMH-RCTKEMKKSA-N
Literature Reference Author M.HAASE-HELD,M.HATZIS,J.MANN
Literature Reference Citation J.CHEM.SOC.PERKIN-1,2907(1993)
Literature Reference DOI 10.1039/p19930002907
Molecular Weight 402.574 g/mol
Solvent CDCl3
Source File Reference UWCS18951