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PODAND-#1
SpectraBase Compound ID JEiaOHIOf8F
InChI InChI=1S/C26H42N12O3/c1-26(14-30-23(39)27-8-5-20-11-36(2)17-33-20,15-31-24(40)28-9-6-21-12-37(3)18-34-21)16-32-25(41)29-10-7-22-13-38(4)19-35-22/h11-13,17-19H,5-10,14-16H2,1-4H3,(H2,27,30,39)(H2,28,31,40)(H2,29,32,41)
InChIKey YIQQCIAYAKNDFH-UHFFFAOYSA-N
Mol Weight 570.7 g/mol
Molecular Formula C26H42N12O3
Exact Mass 570.350283 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I9TTBaNtc50
Name PODAND-#1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H42N12O3
InChI InChI=1S/C26H42N12O3/c1-26(14-30-23(39)27-8-5-20-11-36(2)17-33-20,15-31-24(40)28-9-6-21-12-37(3)18-34-21)16-32-25(41)29-10-7-22-13-38(4)19-35-22/h11-13,17-19H,5-10,14-16H2,1-4H3,(H2,27,30,39)(H2,28,31,40)(H2,29,32,41)
InChIKey YIQQCIAYAKNDFH-UHFFFAOYSA-N
Literature Reference Author R.JAIRAM,P.G.POTVIN
Literature Reference Citation J.ORG.CHEM.,57,4136(1992)
Literature Reference DOI 10.1021/jo00041a016
Molecular Weight 570.698 g/mol
Solvent D2O
Source File Reference UWCS2363