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1-(3-TERT.-BUTOXYCARBONYLAMINO)-3,5-BIS-(2-CARBOXYETHYL)-ADAMANTANE

View entire compound with spectra: 1 NMR

1-(3-TERT.-BUTOXYCARBONYLAMINO)-3,5-BIS-(2-CARBOXYETHYL)-ADAMANTANE
SpectraBase Compound ID 5AWcPftTS4f
InChI InChI=1S/C21H33NO6/c1-18(2,3)28-17(27)22-21-10-14-8-19(12-21,6-4-15(23)24)11-20(9-14,13-21)7-5-16(25)26/h14H,4-13H2,1-3H3,(H,22,27)(H,23,24)(H,25,26)/t14-,19+,20-,21-
InChIKey IHLUOZMXGSBQSC-FYDCZTCXSA-N
Mol Weight 395.5 g/mol
Molecular Formula C21H33NO6
Exact Mass 395.230788 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3RO91rfaAW9
Name 1-(3-TERT.-BUTOXYCARBONYLAMINO)-3,5-BIS-(2-CARBOXYETHYL)-ADAMANTANE
Compound Number 8B
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H33NO6
InChI InChI=1S/C21H33NO6/c1-18(2,3)28-17(27)22-21-10-14-8-19(12-21,6-4-15(23)24)11-20(9-14,13-21)7-5-16(25)26/h14H,4-13H2,1-3H3,(H,22,27)(H,23,24)(H,25,26)/t14-,19+,20-,21-
InChIKey IHLUOZMXGSBQSC-FYDCZTCXSA-N
Literature Reference Author D.CLAES,M.HOLZAPFEL,N.CLAUSEN,W.MAISON
Literature Reference Citation EUR.J.ORG.CHEM.,2013,6361(2013)
Literature Reference DOI 10.1002/ejoc.201300769
Molecular Weight 395.496 g/mol
Solvent CD3OD
Source File Reference UWBT20166