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1,3,4,6-Pentalenetetracarboxylic acid, octahydro-3a-(3-methoxy-3-oxopropyl)-2,5-dioxo-, tetramethyl ester
SpectraBase Compound ID 6f4hJywbaBG
InChI InChI=1S/C20H24O12/c1-28-8(21)6-7-20-11(9(16(24)29-2)14(22)12(20)18(26)31-4)10(17(25)30-3)15(23)13(20)19(27)32-5/h9-13H,6-7H2,1-5H3
InChIKey ZTSSPPCSHDEREX-UHFFFAOYSA-N
Mol Weight 456.4 g/mol
Molecular Formula C20H24O12
Exact Mass 456.126776 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5UxPi6gY0gf
Name 1,3,4,6-Pentalenetetracarboxylic acid, octahydro-3a-(3-methoxy-3-oxopropyl)-2,5-dioxo-, tetramethyl ester
CAS Registry Number 62939-56-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H24O12
InChI InChI=1S/C20H24O12/c1-28-8(21)6-7-20-11(9(16(24)29-2)14(22)12(20)18(26)31-4)10(17(25)30-3)15(23)13(20)19(27)32-5/h9-13H,6-7H2,1-5H3
InChIKey ZTSSPPCSHDEREX-UHFFFAOYSA-N
Molecular Weight 456.400 g/mol
SMILES C12(C(C(=O)C(C1C(C(=O)OC)C(C2C(=O)OC)=O)C(=O)OC)C(=O)OC)CCC(=O)OC
SPLASH splash10-06r6-0019100000-d7c5a3cc45c53a1fdc69
Source of Spectrum F-37-4537-0
Synonyms Tetramethyl 1-(2'-methoxycarbonylethyl)bicyclo[3.3.0]octane-3,7-dione-2,4,6,8-tetracarboxylate Tetramethyl 3a-(3-methoxy-3-oxopropyl)-2,5-dioxooctahydro-1,3,4,6-pentalenetetracarboxylate
Wiley ID 1389185