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3-[(S)-2-METHYLBUTYRYLOXY]-COSTU-1(10),4(5)-DIEN-12,6-ALPHA-OLIDE
SpectraBase Compound ID 9vGrNowjqUR
InChI InChI=1S/C20H28O4/c1-6-13(3)19(21)23-17-10-8-12(2)7-9-16-15(5)20(22)24-18(16)11-14(17)4/h8,11,13,16-18H,5-7,9-10H2,1-4H3/b12-8+,14-11+/t13-,16-,17-,18+/m0/s1
InChIKey WKXIPHPAAYUVHH-RDUHULAMSA-N
Mol Weight 332.44 g/mol
Molecular Formula C20H28O4
Exact Mass 332.198759 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Iddz17M7JHC
Name 3-[(S)-2-METHYLBUTYRYLOXY]-COSTU-1(10),4(5)-DIEN-12,6-ALPHA-OLIDE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H28O4
InChI InChI=1S/C20H28O4/c1-6-13(3)19(21)23-17-10-8-12(2)7-9-16-15(5)20(22)24-18(16)11-14(17)4/h8,11,13,16-18H,5-7,9-10H2,1-4H3/b12-8+,14-11+/t13-,16-,17-,18+/m0/s1
InChIKey WKXIPHPAAYUVHH-RDUHULAMSA-N
Literature Reference Author M.H.BANG,M.W.HAN,M.C.SONG,J.G.CHO,H.G.CHUNG,T.S.JEONG,K.T.LE E,M.S.CHOI
Literature Reference Citation CHEM.PHARM.BULL.,56,1168(2008)
Literature Reference DOI 10.1248/cpb.56.1168
Molecular Weight 332.440 g/mol
Sample ID 2085
Solvent CDCl3