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CHRYSOPHANEIN

View entire compound with spectra: 2 NMR

CHRYSOPHANEIN
SpectraBase Compound ID AuuvnIVBntO
InChI InChI=1S/C21H20O9/c1-8-5-10-14(11(23)6-8)18(26)15-9(16(10)24)3-2-4-12(15)29-21-20(28)19(27)17(25)13(7-22)30-21/h2-6,13,17,19-23,25,27-28H,7H2,1H3/t13-,17-,19+,20-,21-/m1/s1
InChIKey WMMOMSNMMDMSRB-JNHRPPPUSA-N
Mol Weight 416.38 g/mol
Molecular Formula C21H20O9
Exact Mass 416.110732 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HF1kKx4TN1W
Name CHRYSOPHANEIN
Compound Number 6
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H20O9
InChI InChI=1S/C21H20O9/c1-8-5-10-14(11(23)6-8)18(26)15-9(16(10)24)3-2-4-12(15)29-21-20(28)19(27)17(25)13(7-22)30-21/h2-6,13,17,19-23,25,27-28H,7H2,1H3/t13-,17-,19+,20-,21-/m1/s1
InChIKey WMMOMSNMMDMSRB-JNHRPPPUSA-N
Literature Reference Author D.B.DOMINGUEZ-CARMONA,F.ESCALANTE-EROSA,K.GARCIA-SOSA,G.RUIZ -PINELL
Literature Reference Citation J.BRAZ.CHEM.SOC.,22,1279(2011)
Literature Reference DOI 10.1590/s0103-50532011000700013
Molecular Weight 416.384 g/mol
Source File Reference UWBT5674