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PERGILONE
SpectraBase Compound ID 1cnvBYnYUaa
InChI InChI=1S/C26H37NO8/c1-12(28)34-19-14-9-15-18(19)24(32-5,10-16(14)31-4)26(33-6)21(35-13(2)29)20-23(3)8-7-17(30)25(15,20)22(26)27-11-23/h14-16,18-22,27H,7-11H2,1-6H3/t14-,15?,16+,18?,19+,20?,21-,22?,23+,24-,25+,26-/m1/s1
InChIKey KHLANGIAWTYCRD-BPNCYWCRSA-N
Mol Weight 491.6 g/mol
Molecular Formula C26H37NO8
Exact Mass 491.251917 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AiXnaLmToKy
Name PERGILONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H37NO8
InChI InChI=1S/C26H37NO8/c1-12(28)34-19-14-9-15-18(19)24(32-5,10-16(14)31-4)26(33-6)21(35-13(2)29)20-23(3)8-7-17(30)25(15,20)22(26)27-11-23/h14-16,18-22,27H,7-11H2,1-6H3/t14-,15?,16+,18?,19+,20?,21-,22?,23+,24-,25+,26-/m1/s1
InChIKey KHLANGIAWTYCRD-BPNCYWCRSA-N
Literature Reference Author A.ULUBELEN,A.H.MERICLI,F.MERICLI,R.ILARSLAN
Literature Reference Citation PHYTOCHEM.,31,1019(1992)
Literature Reference DOI 10.1016/0031-9422(92)80061-i
Molecular Weight 491.582 g/mol
Solvent CDCl3
Source File Reference UWVN5024