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6,7-Diazabicyclo[3.2.2]non-8-ene-6,7-dicarboxylic acid, 2,2,4-triethoxy-, diethyl ester, (1.alpha.,4.alpha.,5.alpha.)-
SpectraBase Compound ID JUGaNBaptUU
InChI InChI=1S/C19H32N2O7/c1-6-24-15-13-19(27-9-4,28-10-5)16-12-11-14(15)20(17(22)25-7-2)21(16)18(23)26-8-3/h11-12,14-16H,6-10,13H2,1-5H3/t14-,15+,16+/m1/s1
InChIKey UJKDJMADDNAQEM-PMPSAXMXSA-N
Mol Weight 400.5 g/mol
Molecular Formula C19H32N2O7
Exact Mass 400.220951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JtwsYGcJ00H
Name 6,7-Diazabicyclo[3.2.2]non-8-ene-6,7-dicarboxylic acid, 2,2,4-triethoxy-, diethyl ester, (1.alpha.,4.alpha.,5.alpha.)-
Alternate Name(s) Diethyl (1S,4S,5R)-2,2,4-triethoxy-6,7-diazabicyclo[3.2.2]non-8-ene-6,7-dicarboxylate Diethyl 2,3,4-triethoxy-6,7-diazabicyclo[3.2.2]non-8-ene-6,7-dicarboxylate
CAS Registry Number 130792-21-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H32N2O7
InChI InChI=1S/C19H32N2O7/c1-6-24-15-13-19(27-9-4,28-10-5)16-12-11-14(15)20(17(22)25-7-2)21(16)18(23)26-8-3/h11-12,14-16H,6-10,13H2,1-5H3/t14-,15+,16+/m1/s1
InChIKey UJKDJMADDNAQEM-PMPSAXMXSA-N
Molecular Weight 400.472 g/mol
SMILES [C@]12(N(N([C@](C(C[C@@]2(OCC)[H])(OCC)OCC)(C=C1)[H])C(=O)OCC)C(=O)OCC)[H]
SPLASH splash10-001j-4901000000-6d15ebce40acaf6c880f
Source of Spectrum KC-1990-2340-20
Wiley ID 1369280