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(1-BETA,2-BETA,3-BETA)-(+/-)-3-[(2-METHOXYETHOXY)-METHOXY]-2-[2-(PHENYLMETHOXY)-ETHYL]-CYCLOPENTANEACETONITRILE
SpectraBase Compound ID EeortqHsAEq
InChI InChI=1S/C20H29NO4/c1-22-13-14-24-16-25-20-8-7-18(9-11-21)19(20)10-12-23-15-17-5-3-2-4-6-17/h2-6,18-20H,7-10,12-16H2,1H3/t18-,19+,20-/m1/s1
InChIKey AOHQCCUTJWOHOQ-HSALFYBXSA-N
Mol Weight 347.46 g/mol
Molecular Formula C20H29NO4
Exact Mass 347.209658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KSp1C44NrTb
Name (1-BETA,2-BETA,3-BETA)-(+/-)-3-[(2-METHOXYETHOXY)-METHOXY]-2-[2-(PHENYLMETHOXY)-ETHYL]-CYCLOPENTANEACETONITRILE
Compound Number 54
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H29NO4
InChI InChI=1S/C20H29NO4/c1-22-13-14-24-16-25-20-8-7-18(9-11-21)19(20)10-12-23-15-17-5-3-2-4-6-17/h2-6,18-20H,7-10,12-16H2,1H3/t18-,19+,20-/m1/s1
InChIKey AOHQCCUTJWOHOQ-HSALFYBXSA-N
Literature Reference Author M.SANNIGRAHI,D.L.MAYHEW,D.L.J.CLIVE
Literature Reference Citation J.ORG.CHEM.,64,2776(1999)
Literature Reference DOI 10.1021/jo982225m
Molecular Weight 347.455 g/mol
Sample ID 58818
Solvent CD2Cl2