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3'',4''-DIHYDROCAPNOLACTONE;(2'E,2''S,4''S)-7-[4'-(4''-METHYL-5''-OXO-2''-TETRAHYDROFURANYL)-3'-METHYL-2'-BUTENYLOXY]-COUMARIN
SpectraBase Compound ID GCTYsvk846P
InChI InChI=1S/C19H20O5/c1-12(9-16-10-13(2)19(21)23-16)7-8-22-15-5-3-14-4-6-18(20)24-17(14)11-15/h3-7,11,13,16H,8-10H2,1-2H3/b12-7+/t13-,16+/m1/s1
InChIKey LABSWNJPBIVCBD-DKJWJZGOSA-N
Mol Weight 328.36 g/mol
Molecular Formula C19H20O5
Exact Mass 328.131074 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EfCtkUFzG3y
Name 3'',4''-DIHYDROCAPNOLACTONE;(2'E,2''S,4''S)-7-[4'-(4''-METHYL-5''-OXO-2''-TETRAHYDROFURANYL)-3'-METHYL-2'-BUTENYLOXY]-COUMARIN
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H20O5
InChI InChI=1S/C19H20O5/c1-12(9-16-10-13(2)19(21)23-16)7-8-22-15-5-3-14-4-6-18(20)24-17(14)11-15/h3-7,11,13,16H,8-10H2,1-2H3/b12-7+/t13-,16+/m1/s1
InChIKey LABSWNJPBIVCBD-DKJWJZGOSA-N
Literature Reference Author M.RAHMANI,R.A.SUSIDARTI,H.B.M.ISMAIL,M.A.SUKARI,T.Y.Y.HIN,G. E.C.LIAN,A.M.ALI,J.K
Literature Reference Citation PHYTOCHEM.,64,873(2003)
Literature Reference DOI 10.1016/j.phytochem.2003.08.007
Molecular Weight 328.365 g/mol
Solvent CDCl3
Source File Reference UWKP5822