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QNEMJNIGIHMBGC-UHFFFAOYSA-M
SpectraBase Compound ID 9Ktntrrny9q
InChI InChI=1S/C25H19O3.ClHO4/c1-18(26)27-23-14-12-19(13-15-23)22-16-24(20-8-4-2-5-9-20)28-25(17-22)21-10-6-3-7-11-21;2-1(3,4)5/h2-17H,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey QNEMJNIGIHMBGC-UHFFFAOYSA-M
Mol Weight 466.87 g/mol
Molecular Formula C25H19ClO7
Exact Mass 466.081931 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1aCqVfBsJkz
Name QNEMJNIGIHMBGC-UHFFFAOYSA-M
Compound Number 15A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C25H19ClO7
InChI InChI=1S/C25H19O3.ClHO4/c1-18(26)27-23-14-12-19(13-15-23)22-16-24(20-8-4-2-5-9-20)28-25(17-22)21-10-6-3-7-11-21;2-1(3,4)5/h2-17H,1H3;(H,2,3,4,5)/q+1;/p-1
InChIKey QNEMJNIGIHMBGC-UHFFFAOYSA-M
Literature Reference Author A.R.KATRITZKY,O.A.SCHWARZ,A.E.A.RAHMAN,D.E.LEAHY
Literature Reference Citation J.HETCYCL.CHEM.,21,1673(1984)
Literature Reference DOI 10.1002/jhet.5570210621
Molecular Weight 466.875 g/mol
Solvent DMSO-D6
Source File Reference UWCS9267