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PROPANOYLBITALIN_A
SpectraBase Compound ID HHsrEE5XeTR
InChI InChI=1S/C16H18O4/c1-4-16(18)19-9-10(2)15-8-13-7-12(11(3)17)5-6-14(13)20-15/h5-7,15H,2,4,8-9H2,1,3H3/t15-/m1/s1
InChIKey DPSYWRWKIKPZLH-OAHLLOKOSA-N
Mol Weight 274.32 g/mol
Molecular Formula C16H18O4
Exact Mass 274.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9hmQhZsg0qZ
Name PROPANOYLBITALIN_A
Compound Number 9D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H18O4
InChI InChI=1S/C16H18O4/c1-4-16(18)19-9-10(2)15-8-13-7-12(11(3)17)5-6-14(13)20-15/h5-7,15H,2,4,8-9H2,1,3H3/t15-/m1/s1
InChIKey DPSYWRWKIKPZLH-OAHLLOKOSA-N
Literature Reference Author O.TAGLIALATELA-SCAFATI,F.POLLASTRO,G.CHIANESE,A.MINASSI,S.GI BBONS,W.ARUNOTAYANUM
Literature Reference Citation J.NAT.PROD.,76,346(2013)
Literature Reference DOI 10.1021/np3007149
Molecular Weight 274.317 g/mol
Sample ID 42275
Solvent CDCl3