John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=7npyLFB2uJc SpectraBase Spectrum ID=KkLVnYITYh8

(accessed ).
(3R,5S,1'S)-5-[1-(BENZYLOXYCARBONYLAMINO)-2-METHYLPROPYL]-3-PENTYLTETRAHYDROFURAN-2-ONE
SpectraBase Compound ID 7npyLFB2uJc
InChI InChI=1S/C21H31NO4/c1-4-5-7-12-17-13-18(26-20(17)23)19(15(2)3)22-21(24)25-14-16-10-8-6-9-11-16/h6,8-11,15,17-19H,4-5,7,12-14H2,1-3H3,(H,22,24)/t17-,18+,19-/m1/s1
InChIKey KZOAMCDUGZRQML-CEXWTWQISA-N
Mol Weight 361.48 g/mol
Molecular Formula C21H31NO4
Exact Mass 361.225309 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KkLVnYITYh8
Name (3R,5S,1'S)-5-[1-(BENZYLOXYCARBONYLAMINO)-2-METHYLPROPYL]-3-PENTYLTETRAHYDROFURAN-2-ONE
Compound Number 4B
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H31NO4
InChI InChI=1S/C21H31NO4/c1-4-5-7-12-17-13-18(26-20(17)23)19(15(2)3)22-21(24)25-14-16-10-8-6-9-11-16/h6,8-11,15,17-19H,4-5,7,12-14H2,1-3H3,(H,22,24)/t17-,18+,19-/m1/s1
InChIKey KZOAMCDUGZRQML-CEXWTWQISA-N
Literature Reference Author S.STEURER,J.PODLECH
Literature Reference Citation ORG.LETTERS,1,481(1999)
Literature Reference DOI 10.1021/ol990672y
Molecular Weight 361.481 g/mol
Solvent CDCl3
Source File Reference UWSI26205
SpectraBase Batch ID 9Gk00LcvJYA