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[1R,(2Z)]-1-[(1S)-1-[[(4S)-4-ISOPROPYL-2-OXO-1,3-OXAZOLIDIN-3-YL]-CARBONYL]-4-METHYL-PENT-4-ENYL]-3,7-DIMETHYL-OCTA-2,6-DIENYL-4-BROMOBENZOATE
SpectraBase Compound ID 5r9Ru8ALJP3
InChI InChI=1S/C30H40BrNO5/c1-19(2)9-8-10-22(7)17-27(37-29(34)23-12-14-24(31)15-13-23)25(16-11-20(3)4)28(33)32-26(21(5)6)18-36-30(32)35/h9,12-15,17,21,25-27H,3,8,10-11,16,18H2,1-2,4-7H3/b22-17-/t25-,26+,27+/m0/s1
InChIKey UXMPRTIRSBZGLH-JTZFLUTOSA-N
Mol Weight 574.6 g/mol
Molecular Formula C30H40BrNO5
Exact Mass 573.208986 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KgNBxrdUwQj
Name [1R,(2Z)]-1-[(1S)-1-[[(4S)-4-ISOPROPYL-2-OXO-1,3-OXAZOLIDIN-3-YL]-CARBONYL]-4-METHYL-PENT-4-ENYL]-3,7-DIMETHYL-OCTA-2,6-DIENYL-4-BROMOBENZOATE
Compound Number 26
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H40BrNO5
InChI InChI=1S/C30H40BrNO5/c1-19(2)9-8-10-22(7)17-27(37-29(34)23-12-14-24(31)15-13-23)25(16-11-20(3)4)28(33)32-26(21(5)6)18-36-30(32)35/h9,12-15,17,21,25-27H,3,8,10-11,16,18H2,1-2,4-7H3/b22-17-/t25-,26+,27+/m0/s1
InChIKey UXMPRTIRSBZGLH-JTZFLUTOSA-N
Literature Reference Author S.KRIENING,A.EVAGELOU,B.CLAASEN,A.BARO,S.LASCHAT
Literature Reference Citation EUR.J.ORG.CHEM.,2014,6720(2014)
Literature Reference DOI 10.1002/ejoc.201402736
Molecular Weight 574.555 g/mol
Solvent CDCl3
Source File Reference UWIR19446