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S-TRANS-METHYLDAMBULLIN;S-CIS-(E)-3-(METHYLSULPHONYL)-PROPENOIC-ACID-N-METHYL-PARA-(3-METHYL-2-BUTENYLOXY)-PHENETHYLAMIDE

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S-TRANS-METHYLDAMBULLIN;S-CIS-(E)-3-(METHYLSULPHONYL)-PROPENOIC-ACID-N-METHYL-PARA-(3-METHYL-2-BUTENYLOXY)-PHENETHYLAMIDE
SpectraBase Compound ID IzpBz4zEM80
InChI InChI=1S/C18H25NO4S/c1-15(2)10-13-23-17-7-5-16(6-8-17)9-12-19(3)18(20)11-14-24(4,21)22/h5-8,10-11,14H,9,12-13H2,1-4H3/b14-11+
InChIKey NKBBYRJYKGXDCB-SDNWHVSQSA-N
Mol Weight 351.46 g/mol
Molecular Formula C18H25NO4S
Exact Mass 351.150429 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8OMNmWWWs68
Name S-TRANS-METHYLDAMBULLIN;S-CIS-(E)-3-(METHYLSULPHONYL)-PROPENOIC-ACID-N-METHYL-PARA-(3-METHYL-2-BUTENYLOXY)-PHENETHYLAMIDE
Compound Number 11
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H25NO4S
InChI InChI=1S/C18H25NO4S/c1-15(2)10-13-23-17-7-5-16(6-8-17)9-12-19(3)18(20)11-14-24(4,21)22/h5-8,10-11,14H,9,12-13H2,1-4H3/b14-11+
InChIKey NKBBYRJYKGXDCB-SDNWHVSQSA-N
Literature Reference Author H.GREGER,O.HOFER,G.ZECHNER,F.HADACEK,G.WURZ
Literature Reference Citation PHYTOCHEM.,37,1305(1994)
Literature Reference DOI 10.1016/S0031-9422(00)90403-5
Molecular Weight 351.461 g/mol
Solvent CDCl3
Source File Reference UWCS21019