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2-(1-Acetoxy-3-ethoxycarbonyl-4-hydroxynaphthalen-2-yl)malonic acid diethyl ester
SpectraBase Compound ID Ab9hiRZIAAX
InChI InChI=1S/C22H24O9/c1-5-28-20(25)16-15(17(21(26)29-6-2)22(27)30-7-3)19(31-12(4)23)14-11-9-8-10-13(14)18(16)24/h8-11,17,24H,5-7H2,1-4H3
InChIKey QFSXKAMGRKXZFD-UHFFFAOYSA-N
Mol Weight 432.43 g/mol
Molecular Formula C22H24O9
Exact Mass 432.142032 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7m7N5RUizoS
Name 2-(1-Acetoxy-3-ethoxycarbonyl-4-hydroxynaphthalen-2-yl)malonic acid diethyl ester
Alternate Name(s) Diethyl 2-[1-(acetyloxy)-3-(ethoxycarbonyl)-4-hydroxy-2-naphthyl]malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24O9
InChI InChI=1S/C22H24O9/c1-5-28-20(25)16-15(17(21(26)29-6-2)22(27)30-7-3)19(31-12(4)23)14-11-9-8-10-13(14)18(16)24/h8-11,17,24H,5-7H2,1-4H3
InChIKey QFSXKAMGRKXZFD-UHFFFAOYSA-N
Molecular Weight 432.425 g/mol
SMILES Oc1c(c(C(C(=O)OCC)C(=O)OCC)c(c2c1cccc2)OC(=O)C)C(=O)OCC
SPLASH splash10-0f95-0193000000-d5766913bbc5f0d4f631
Source of Spectrum KC-61-9138-29
Wiley ID 1630569