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ALLYL-2-[(TRANS-2-ACETOXY-2,6,6-TRIMETHYLCYCLOHEXYL)-ETHYL]-3-OXO-HEPT-6-ENOATE,DIASTEREOMER-#1
SpectraBase Compound ID DQoQlXFN8a5
InChI InChI=1S/C23H36O5/c1-7-9-11-19(25)18(21(26)27-16-8-2)12-13-20-22(4,5)14-10-15-23(20,6)28-17(3)24/h7-8,18,20H,1-2,9-16H2,3-6H3/t18?,20-,23-/m1/s1
InChIKey CBOCYJDBVRMFHY-JSNZXPNTSA-N
Mol Weight 392.5 g/mol
Molecular Formula C23H36O5
Exact Mass 392.256274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8ym6Jy8ooei
Name ALLYL-2-[(TRANS-2-ACETOXY-2,6,6-TRIMETHYLCYCLOHEXYL)-ETHYL]-3-OXO-HEPT-6-ENOATE,DIASTEREOMER-#1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H36O5
InChI InChI=1S/C23H36O5/c1-7-9-11-19(25)18(21(26)27-16-8-2)12-13-20-22(4,5)14-10-15-23(20,6)28-17(3)24/h7-8,18,20H,1-2,9-16H2,3-6H3/t18?,20-,23-/m1/s1
InChIKey CBOCYJDBVRMFHY-JSNZXPNTSA-N
Literature Reference Author B.B.SNIDER,B.O.BUCKMAN
Literature Reference Citation J.ORG.CHEM.,57,4883(1992)
Literature Reference DOI 10.1021/jo00044a024
Molecular Weight 392.536 g/mol
Solvent CDCl3
Source File Reference UWCS1666