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(+/-)-1-ALPHA-BENZOYLOXY-3-BETA-[6-METHOXYCARBONYL-3-OXO-(1E)-HEXENYL]-2-ALPHA-OCTYL-4-ALPHA-(2-TETRAHYDROPYRANYLOXY)-CYClOPENTANE

View entire compound with spectra: 1 NMR

(+/-)-1-ALPHA-BENZOYLOXY-3-BETA-[6-METHOXYCARBONYL-3-OXO-(1E)-HEXENYL]-2-ALPHA-OCTYL-4-ALPHA-(2-TETRAHYDROPYRANYLOXY)-CYClOPENTANE
SpectraBase Compound ID LKywLeSjKP9
InChI InChI=1S/2C33H48O7/c2*1-3-4-5-6-7-11-18-27-28(22-21-26(34)17-14-19-31(35)37-2)29(39-32-20-12-13-23-38-32)24-30(27)40-33(36)25-15-9-8-10-16-25/h2*8-10,15-16,21-22,27-30,32H,3-7,11-14,17-20,23-24H2,1-2H3/b2*22-21+/t2*27-,28-,29-,30+,32?/m10/s1
InChIKey VIIVAPRFSDXMRM-SDCKGYOVSA-N
Mol Weight 1113.5 g/mol
Molecular Formula C66H96O14
Exact Mass 1112.680008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EMXxTacwFez
Name (+/-)-1-ALPHA-BENZOYLOXY-3-BETA-[6-METHOXYCARBONYL-3-OXO-(1E)-HEXENYL]-2-ALPHA-OCTYL-4-ALPHA-(2-TETRAHYDROPYRANYLOXY)-CYClOPENTANE
Compound Number XIV
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C66H96O14
InChI InChI=1S/2C33H48O7/c2*1-3-4-5-6-7-11-18-27-28(22-21-26(34)17-14-19-31(35)37-2)29(39-32-20-12-13-23-38-32)24-30(27)40-33(36)25-15-9-8-10-16-25/h2*8-10,15-16,21-22,27-30,32H,3-7,11-14,17-20,23-24H2,1-2H3/b2*22-21+/t2*27-,28-,29-,30+,32?/m10/s1
InChIKey VIIVAPRFSDXMRM-SDCKGYOVSA-N
Literature Reference Author R.R.AKHMETVALEEV,R.V.BIKBULATOV,T.A.BELOGAEVA,F.A.AKBUTINA,M .S.MIFTAKHOV
Literature Reference Citation RUSS.J.ORG.CHEM.,38,361(2002)
Literature Reference DOI 10.1023/A:1016325923944
Molecular Weight 1113.480 g/mol
Solvent CDCl3
Source File Reference UWMZ9812