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(Z)-Diethyl 4-(2-oxohexylidene)-6,7-diazabicyclo[3.2.2]non-2-en-6,7-dicarboxylate

View entire compound with spectra: 1 MS (GC)

(Z)-Diethyl 4-(2-oxohexylidene)-6,7-diazabicyclo[3.2.2]non-2-en-6,7-dicarboxylate
SpectraBase Compound ID 5XDEfpcBren
InChI InChI=1S/C19H28N2O5/c1-4-7-8-16(22)13-14-9-10-15-11-12-17(14)21(19(24)26-6-3)20(15)18(23)25-5-2/h9-10,13,15,17H,4-8,11-12H2,1-3H3/b14-13-/t15-,17-/m1/s1
InChIKey CTRZGRBDOLVBIB-XQJAURSCSA-N
Mol Weight 364.44 g/mol
Molecular Formula C19H28N2O5
Exact Mass 364.199822 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GTmx790vKFN
Name (Z)-Diethyl 4-(2-oxohexylidene)-6,7-diazabicyclo[3.2.2]non-2-en-6,7-dicarboxylate
Alternate Name(s) Diethyl (4Z)-4-(2-oxohexylidene)-6,7-diazabicyclo[3.2.2]non-2-ene-6,7-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28N2O5
InChI InChI=1S/C19H28N2O5/c1-4-7-8-16(22)13-14-9-10-15-11-12-17(14)21(19(24)26-6-3)20(15)18(23)25-5-2/h9-10,13,15,17H,4-8,11-12H2,1-3H3/b14-13-/t15-,17-/m1/s1
InChIKey CTRZGRBDOLVBIB-XQJAURSCSA-N
Molecular Weight 364.442 g/mol
SMILES C(N1N([C@]2(\C(C=C[C@@]1(CC2)[H])=C\C(=O)CCCC)[H])C(=O)OCC)(=O)OCC
SPLASH splash10-004i-9701000000-188d4e644b56110bba3a
Source of Spectrum KC-1992-2220-20
Wiley ID 776856