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3-[(R/S)-1-ALLYLOXYCARBONYL-2-(ALLYLOXYCARBONYLAMINO)-ETHYLSULFANYL]-(R)-2-(FLUOREN-9-YLMETHOXYCARBONYLAMINO)-PROPIONIC-ACID

View entire compound with spectra: 1 NMR

3-[(R/S)-1-ALLYLOXYCARBONYL-2-(ALLYLOXYCARBONYLAMINO)-ETHYLSULFANYL]-(R)-2-(FLUOREN-9-YLMETHOXYCARBONYLAMINO)-PROPIONIC-ACID
SpectraBase Compound ID ARtjWKTkqW3
InChI InChI=1S/2C28H30N2O8S/c2*1-3-13-36-26(33)24(15-29-27(34)37-14-4-2)39-17-23(25(31)32)30-28(35)38-16-22-20-11-7-5-9-18(20)19-10-6-8-12-21(19)22/h2*3-12,22-24H,1-2,13-17H2,(H,29,34)(H,30,35)(H,31,32)/t2*23-,24?/m00/s1
InChIKey UTSDNNVCOVMOEQ-IROIWWAPSA-N
Mol Weight 1109.23 g/mol
Molecular Formula C56H60N4O16S2
Exact Mass 1108.344574 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5yA04ZqfJ9p
Name 3-[(R/S)-1-ALLYLOXYCARBONYL-2-(ALLYLOXYCARBONYLAMINO)-ETHYLSULFANYL]-(R)-2-(FLUOREN-9-YLMETHOXYCARBONYLAMINO)-PROPIONIC-ACID
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C56H60N4O16S2
InChI InChI=1S/2C28H30N2O8S/c2*1-3-13-36-26(33)24(15-29-27(34)37-14-4-2)39-17-23(25(31)32)30-28(35)38-16-22-20-11-7-5-9-18(20)19-10-6-8-12-21(19)22/h2*3-12,22-24H,1-2,13-17H2,(H,29,34)(H,30,35)(H,31,32)/t2*23-,24?/m00/s1
InChIKey UTSDNNVCOVMOEQ-IROIWWAPSA-N
Literature Reference Author M.F.M.MUSTAPA,R.HARRIS,N.BULIC-SUBANOVIC,S.L.ELLIOTT,S.BREGA NT,M.F.A.GROUSSIER,J
Literature Reference Citation J.ORG.CHEM.,68,8185(2003)
Literature Reference DOI 10.1021/jo0346398
Molecular Weight 1109.230 g/mol
Solvent CDCl3
Source File Reference UWVN21006