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GRSPCLQQQWMGCZ-DJQAVYROSA-N
SpectraBase Compound ID 6xt2tvJzl9t
InChI InChI=1S/C27H44N4O7/c1-7-8-14-19(31-26(35)38-27(2,3)4)22(30-21(25(34)37-6)16-23(32)36-5)17-29-20(24(28)33)15-18-12-10-9-11-13-18/h9-13,19-22,29-30H,7-8,14-17H2,1-6H3,(H2,28,33)(H,31,35)/t19-,20+,21+,22?/m0/s1
InChIKey GRSPCLQQQWMGCZ-DJQAVYROSA-N
Mol Weight 536.7 g/mol
Molecular Formula C27H44N4O7
Exact Mass 536.321 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6JKUi7iDDQp
Name GRSPCLQQQWMGCZ-DJQAVYROSA-N
Compound Number (R)-3C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H44N4O7
InChI InChI=1S/C27H44N4O7/c1-7-8-14-19(31-26(35)38-27(2,3)4)22(30-21(25(34)37-6)16-23(32)36-5)17-29-20(24(28)33)15-18-12-10-9-11-13-18/h9-13,19-22,29-30H,7-8,14-17H2,1-6H3,(H2,28,33)(H,31,35)/t19-,20+,21+,22?/m0/s1
InChIKey GRSPCLQQQWMGCZ-DJQAVYROSA-N
Literature Reference Author S.HERRERO,M.T.GARCIA-LOPEZ,M.LATORRE,E.CENARRUZABEITIA,J.D.R IO,R.HERRANZ
Literature Reference Citation J.ORG.CHEM.,67,3866(2002)
Literature Reference DOI 10.1021/jo0256336
Molecular Weight 536.669 g/mol
Solvent CDCl3
Source File Reference UWLU26048