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SODIUM-8-CARBOXYLATOMETHYL-6-METHYL-2-PHENYL-4H-1-BENZOPYRAN-4-ONE
SpectraBase Compound ID 7Ar6Fe7ivZy
InChI InChI=1S/C18H14O4.Na/c1-11-7-13(9-17(20)21)18-14(8-11)15(19)10-16(22-18)12-5-3-2-4-6-12;/h2-8,10H,9H2,1H3,(H,20,21);/q;+1/p-1
InChIKey QJKXHPIIWPLZRV-UHFFFAOYSA-M
Mol Weight 316.29 g/mol
Molecular Formula C18H13NaO4
Exact Mass 316.071153 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8B1gooBQDAK
Name SODIUM-8-CARBOXYLATOMETHYL-6-METHYL-2-PHENYL-4H-1-BENZOPYRAN-4-ONE
Compound Number 13A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H13NaO4
InChI InChI=1S/C18H14O4.Na/c1-11-7-13(9-17(20)21)18-14(8-11)15(19)10-16(22-18)12-5-3-2-4-6-12;/h2-8,10H,9H2,1H3,(H,20,21);/q;+1/p-1
InChIKey QJKXHPIIWPLZRV-UHFFFAOYSA-M
Literature Reference Author R.A.AITKEN,M.C.BIBBY,J.A.DOUBLE,R.M.PHILLIPS,S.K.SHARMA
Literature Reference Citation ARCH.PHARM.,329,489(1996)
Literature Reference DOI 10.1002/ardp.19963291104
Molecular Weight 316.289 g/mol
Solvent DMSO-D6
Source File Reference UWRU10637