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3,6-Epoxycyclohexa-1,4-diene-1,2,4,5-tetracarboxylic acid, tetraethyl ester

View entire compound with spectra: 2 MS (GC)

3,6-Epoxycyclohexa-1,4-diene-1,2,4,5-tetracarboxylic acid, tetraethyl ester
SpectraBase Compound ID CdYGEQc3ybE
InChI InChI=1S/C18H22O9/c1-5-23-15(19)9-10(16(20)24-6-2)14-12(18(22)26-8-4)11(13(9)27-14)17(21)25-7-3/h13-14H,5-8H2,1-4H3/t13-,14+
InChIKey NUBKZJBLLUQFFZ-OKILXGFUSA-N
Mol Weight 382.37 g/mol
Molecular Formula C18H22O9
Exact Mass 382.126382 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IUPXzn7WTQJ
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C18H22O9
InChI InChI=1S/C18H22O9/c1-5-23-15(19)9-10(16(20)24-6-2)14-12(18(22)26-8-4)11(13(9)27-14)17(21)25-7-3/h13-14H,5-8H2,1-4H3/t13-,14+
InChIKey NUBKZJBLLUQFFZ-OKILXGFUSA-N
Molecular Weight 382.1257
SMILES [C@]12(O[C@](C(C(OCC)=O)=C2C(OCC)=O)(C(C(OCC)=O)=C1C(OCC)=O)[H])[H]
SPLASH splash10-00n0-4931000000-03e3637e8fe569313475
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany