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OCIMARIN;7-HYDROXY_3-(2-HYDROXYETHYL)-4-METHYL-2-H-1-BENZOPYRAN-2-ONE
SpectraBase Compound ID 7oYLSdwICq6
InChI InChI=1S/C12H12O4/c1-7-9-3-2-8(14)6-11(9)16-12(15)10(7)4-5-13/h2-3,6,13-14H,4-5H2,1H3
InChIKey VCGFYFKJZGIZMX-UHFFFAOYSA-N
Mol Weight 220.22 g/mol
Molecular Formula C12H12O4
Exact Mass 220.073559 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID F7DLiDSJobE
Name OCIMARIN;7-HYDROXY_3-(2-HYDROXYETHYL)-4-METHYL-2-H-1-BENZOPYRAN-2-ONE
Compound Number 3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12O4
InChI InChI=1S/C12H12O4/c1-7-9-3-2-8(14)6-11(9)16-12(15)10(7)4-5-13/h2-3,6,13-14H,4-5H2,1H3
InChIKey VCGFYFKJZGIZMX-UHFFFAOYSA-N
Literature Reference Author P.GUPTA,D.K.YADAV,K.B.SIRIPURAPU,G.PALIT,R.MAURYA
Literature Reference Citation J.NAT.PROD.,70,1410(2007)
Literature Reference DOI 10.1021/np0700164
Molecular Weight 220.225 g/mol
Sample ID 31503
Solvent DMSO-D6