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Dimethyl 7,8-Diacetoxy-2-oxa-3,5-diazabicyclo[2.2.2]octane-3,5-dicarboxylate
SpectraBase Compound ID CwCqhhyAeie
InChI InChI=1S/C13H18N2O9/c1-6(16)22-9-8-5-14(12(18)20-3)11(10(9)23-7(2)17)15(24-8)13(19)21-4/h8-11H,5H2,1-4H3/t8-,9?,10?,11+/m0/s1
InChIKey PUEOVRKUSTUXDB-UHFFFAOYSA-N
Mol Weight 346.29 g/mol
Molecular Formula C13H18N2O9
Exact Mass 346.10123 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BV1wnHMggoC
Name Dimethyl 7,8-Diacetoxy-2-oxa-3,5-diazabicyclo[2.2.2]octane-3,5-dicarboxylate
CAS Registry Number 114217-86-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2O9
InChI InChI=1S/C13H18N2O9/c1-6(16)22-9-8-5-14(12(18)20-3)11(10(9)23-7(2)17)15(24-8)13(19)21-4/h8-11H,5H2,1-4H3/t8-,9?,10?,11+/m0/s1
InChIKey PUEOVRKUSTUXDB-UHFFFAOYSA-N
Molecular Weight 346.292 g/mol
SMILES [C@]12(N(O[C@@](CN2C(=O)OC)(C(OC(=O)C)C1OC(=O)C)[H])C(=O)OC)[H]
SPLASH splash10-0f6x-9631000000-1d37c368bedf5e1043c9
Source of Spectrum H-70-567-12
Synonyms Dimethyl 7,8-bis(acetyloxy)-2-oxa-3,5-diazabicyclo[2.2.2]octane-3,5-dicarboxylate
Wiley ID 1338904