John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=4eMXIc4Hcwy SpectraBase Spectrum ID=FdMVyicKGHY

(accessed ).
4-METHYL-5,8-DIOXO-6,7-DIPHENYL-2,6,7-TRIAZABICYCLO-[2.2.2]-OCT-2-ENE-3-CARBOXYLIC-ACID,ETHYLESTER
SpectraBase Compound ID 4eMXIc4Hcwy
InChI InChI=1S/C21H19N3O4/c1-3-28-17(25)16-21(2)18(26)23(14-10-6-4-7-11-14)20(22-16)24(19(21)27)15-12-8-5-9-13-15/h4-13,20H,3H2,1-2H3/t20-,21+
InChIKey MVJAHPAHLSYYFD-OYRHEFFESA-N
Mol Weight 377.4 g/mol
Molecular Formula C21H19N3O4
Exact Mass 377.137556 g/mol

Mass Spectrum (MS)

Mass Spectrum (MS)

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SpectraBase Spectrum ID FdMVyicKGHY
Name 4-Methyl-5,8-dioxo-6,7-diphenyl-2,6,7-triazabicyclo[2.2.2]oct-2-en-3-carbonsaure-ethylester
Alternate Name(s) Ethyl 4-methyl-5,8-dioxo-6,7-diphenyl-2,6,7-triazabicyclo[2.2.2]oct-2-ene-3-carboxylate
CAS Registry Number 100083-10-1
Classification Pyrimidones
Copyright Copyright © 2020-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19N3O4
InChI InChI=1S/C21H19N3O4/c1-3-28-17(25)16-21(2)18(26)23(14-10-6-4-7-11-14)20(22-16)24(19(21)27)15-12-8-5-9-13-15/h4-13,20H,3H2,1-2H3/t20-,21+
InChIKey MVJAHPAHLSYYFD-OYRHEFFESA-N
SPLASH splash10-117i-4790000000-0fc9c7be2be9e96a471d
Source of Spectrum K-119-1450-3
SpectraBase Batch ID K7uOa2oXVb1