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2-BETA-(2-(PHENYLTHIO)-ETHOXY)-CLOVAN-9-ALPHA-OL
SpectraBase Compound ID AgInAIX14sx
InChI InChI=1S/C23H34O2S/c1-21(2)15-20(25-13-14-26-17-7-5-4-6-8-17)23-12-10-19(24)22(3,16-23)11-9-18(21)23/h4-8,18-20,24H,9-16H2,1-3H3/t18-,19+,20-,22+,23-/m0/s1
InChIKey DJLMTUROYCIYRP-SSQPMERFSA-N
Mol Weight 374.6 g/mol
Molecular Formula C23H34O2S
Exact Mass 374.227952 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JXIHLVU19cz
Name 2-BETA-(2-(PHENYLTHIO)-ETHOXY)-CLOVAN-9-ALPHA-OL
Compound Number 19
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H34O2S
InChI InChI=1S/C23H34O2S/c1-21(2)15-20(25-13-14-26-17-7-5-4-6-8-17)23-12-10-19(24)22(3,16-23)11-9-18(21)23/h4-8,18-20,24H,9-16H2,1-3H3/t18-,19+,20-,22+,23-/m0/s1
InChIKey DJLMTUROYCIYRP-SSQPMERFSA-N
Literature Reference Author L.SAIZ-URRA,J.C.RACERO,A.J.MARCIAS-SANCHEZ,R.HERNANDEZ-GALAN ,J.R.HANSON,M.PEREZ-
Literature Reference Citation J.AGR.FOOD.CHEM.,57,2420(2009)
Literature Reference DOI 10.1021/jf8033978
Molecular Weight 374.582 g/mol
Sample ID 41758
Solvent CDCl3