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6,7-Diazabicyclo[3.2.2]non-2-ene-6,7-dicarboxylic acid, 4-hydroxy-4-methyl-, diethyl ester
SpectraBase Compound ID 19WcfJEQYFa
InChI InChI=1S/C14H22N2O5/c1-4-20-12(17)15-10-6-7-11(14(3,19)9-8-10)16(15)13(18)21-5-2/h8-11,19H,4-7H2,1-3H3/t10-,11+,14+/m0/s1
InChIKey NWTQNFPESZJXND-MISXGVKJSA-N
Mol Weight 298.34 g/mol
Molecular Formula C14H22N2O5
Exact Mass 298.152872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CE6mmQfQZKK
Name 6,7-Diazabicyclo[3.2.2]non-2-ene-6,7-dicarboxylic acid, 4-hydroxy-4-methyl-, diethyl ester
Alternate Name(s) Diethyl 2-hydroxy-2-methyl-6,7-diazabicyclo[3.2.2]ono-3-ene-6,7-dicarboxylate Diethyl 4-hydroxy-4-methyl-6,7-diazabicyclo[3.2.2]non-2-ene-6,7-dicarboxylate
CAS Registry Number 130663-72-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22N2O5
InChI InChI=1S/C14H22N2O5/c1-4-20-12(17)15-10-6-7-11(14(3,19)9-8-10)16(15)13(18)21-5-2/h8-11,19H,4-7H2,1-3H3/t10-,11+,14+/m0/s1
InChIKey NWTQNFPESZJXND-MISXGVKJSA-N
Molecular Weight 298.339 g/mol
SMILES O[C@]1([C@@]2(N(N(C(=O)OCC)[C@](C=C1)(CC2)[H])C(=O)OCC)[H])C
SPLASH splash10-004i-9300000000-fbdda5be34df3b9aa08b
Source of Spectrum KC-1990-2341-26
Wiley ID 1300680