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9-[(1,3-DIUNDECANOYLOXY-2-PROPOXY)-METHYL]-GUANINE

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9-[(1,3-DIUNDECANOYLOXY-2-PROPOXY)-METHYL]-GUANINE
SpectraBase Compound ID 8aZ4pdP2JZ0
InChI InChI=1S/C31H53N5O6/c1-3-5-7-9-11-13-15-17-19-26(37)40-21-25(22-41-27(38)20-18-16-14-12-10-8-6-4-2)42-24-36-23-33-28-29(36)34-31(32)35-30(28)39/h23,25H,3-22,24H2,1-2H3,(H3,32,34,35,39)
InChIKey WDBCXZWQVUSEPI-UHFFFAOYSA-N
Mol Weight 591.8 g/mol
Molecular Formula C31H53N5O6
Exact Mass 591.399584 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H7XLKJQ4Sbi
Name 9-[(1,3-DIUNDECANOYLOXY-2-PROPOXY)-METHYL]-GUANINE
Compound Number 2F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C31H53N5O6
InChI InChI=1S/C31H53N5O6/c1-3-5-7-9-11-13-15-17-19-26(37)40-21-25(22-41-27(38)20-18-16-14-12-10-8-6-4-2)42-24-36-23-33-28-29(36)34-31(32)35-30(28)39/h23,25H,3-22,24H2,1-2H3,(H3,32,34,35,39)
InChIKey WDBCXZWQVUSEPI-UHFFFAOYSA-N
Literature Reference Author H.GAO,A.K.MITRA
Literature Reference Citation MAGN.RES.CHEM.,38,696(2000)
Literature Reference DOI 10.1002/1097-458x(200008)38:8<696::aid-mrc655>3.3.co;2-y
Molecular Weight 591.792 g/mol
Solvent CDCl3
Source File Reference UWSI3444