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(+/-)-4-ALPHA-HYDROXY-3-BETA-[(3S)-HYDROXY-6-CARBOXY-(1E)-HEXENYL]-2-ALPHA-OCTYLCYClOPENTANONE
SpectraBase Compound ID BsrWFqJUefR
InChI InChI=1S/C20H34O5/c1-2-3-4-5-6-7-10-16-17(19(23)14-18(16)22)13-12-15(21)9-8-11-20(24)25/h12-13,15-17,19,21,23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16-,17-,19-/m1/s1
InChIKey REUXWGPUFRYRQQ-CHCORRSHSA-N
Mol Weight 354.5 g/mol
Molecular Formula C20H34O5
Exact Mass 354.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1YAOP2BZwqJ
Name (+/-)-4-ALPHA-HYDROXY-3-BETA-[(3S)-HYDROXY-6-CARBOXY-(1E)-HEXENYL]-2-ALPHA-OCTYLCYClOPENTANONE
Compound Number I I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H34O5
InChI InChI=1S/C20H34O5/c1-2-3-4-5-6-7-10-16-17(19(23)14-18(16)22)13-12-15(21)9-8-11-20(24)25/h12-13,15-17,19,21,23H,2-11,14H2,1H3,(H,24,25)/b13-12+/t15-,16-,17-,19-/m1/s1
InChIKey REUXWGPUFRYRQQ-CHCORRSHSA-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 354.487 g/mol
Solvent CDCl3
Source File Reference UWMZ9809