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N-(9-FLUORENYLMETHOXYCARBONYL)-L-ASPARTYL-BETA-(13)C-METHYL-ALPHA-BENZYLDIESTER
SpectraBase Compound ID I1aR0dIAc4t
InChI InChI=1S/C27H25NO6/c1-32-25(29)15-24(26(30)33-16-18-9-3-2-4-10-18)28-27(31)34-17-23-21-13-7-5-11-19(21)20-12-6-8-14-22(20)23/h2-14,23-24H,15-17H2,1H3,(H,28,31)/t24-/m1/s1/i1+1
InChIKey HXIFRLRELBIUEO-SEVXTGOUSA-N
Mol Weight 460.49 g/mol
Molecular Formula C2613CH25NO6
Exact Mass 460.171542 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2DhCjp1sWTL
Name N-(9-FLUORENYLMETHOXYCARBONYL)-L-ASPARTYL-BETA-(13)C-METHYL-ALPHA-BENZYLDIESTER
Compound Number 5
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H25NO6
InChI InChI=1S/C27H25NO6/c1-32-25(29)15-24(26(30)33-16-18-9-3-2-4-10-18)28-27(31)34-17-23-21-13-7-5-11-19(21)20-12-6-8-14-22(20)23/h2-14,23-24H,15-17H2,1H3,(H,28,31)/t24-/m1/s1/i1+1
InChIKey HXIFRLRELBIUEO-SEVXTGOUSA-N
Literature Reference Author K.THIEME,I.SCHNELL
Literature Reference Citation J.AM.CHEM.SOC.,125,12100(2003)
Literature Reference DOI 10.1021/ja037374n
Molecular Weight 459.499 g/mol
Sample ID 50565
Solvent CDCl3