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OGTYTYOKQRCQEM-UHFFFAOYSA-N

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OGTYTYOKQRCQEM-UHFFFAOYSA-N
SpectraBase Compound ID HSYRbtH0j7x
InChI InChI=1S/C14H12O4/c1-14(2)6-5-9-8-3-4-12(16)17-11(8)7-10(15)13(9)18-14/h3-7,15H,1-2H3
InChIKey OGTYTYOKQRCQEM-UHFFFAOYSA-N
Mol Weight 244.25 g/mol
Molecular Formula C14H12O4
Exact Mass 244.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FN1QA6ytE22
Name CEDRECOUMARIN-A
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H12O4
InChI InChI=1S/C14H12O4/c1-14(2)6-5-9-8-3-4-12(16)17-11(8)7-10(15)13(9)18-14/h3-7,15H,1-2H3
InChIKey OGTYTYOKQRCQEM-UHFFFAOYSA-N
Literature Reference Author N.A.KOORBANALLY,M.RANDRIANARIVELOJOSIA,D.A.MULHOLLAND,L.Q.V. UFFORD,A.J.J.VANDENB
Literature Reference Citation J.NAT.PROD.,65,1349(2002)
Literature Reference DOI 10.1021/np0200562
Molecular Weight 244.247 g/mol
Solvent CD3OD
Source File Reference UWSI5245