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anti-exo-4-ethoxycarbonyl-1,3,3a,4,6,6a-hexahydro-2-(4-methylphenyl)-5-methyl-6-ethy-2H,5H-lpyrrolo[3,4-c]pyrrol-1,3-dione

View entire compound with spectra: 4 MS (GC)

anti-exo-4-ethoxycarbonyl-1,3,3a,4,6,6a-hexahydro-2-(4-methylphenyl)-5-methyl-6-ethy-2H,5H-lpyrrolo[3,4-c]pyrrol-1,3-dione
SpectraBase Compound ID 3NbWA7vINov
InChI InChI=1S/C19H24N2O4/c1-5-13-14-15(16(20(13)4)19(24)25-6-2)18(23)21(17(14)22)12-9-7-11(3)8-10-12/h7-10,13-16H,5-6H2,1-4H3
InChIKey HOLUPEUXIPLRIG-UHFFFAOYSA-N
Mol Weight 344.41 g/mol
Molecular Formula C19H24N2O4
Exact Mass 344.173607 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID App1atlpKjy
Name anti-exo-4-ethoxycarbonyl-1,3,3a,4,6,6a-hexahydro-2-(4-methylphenyl)-5-methyl-6-ethy-2H,5H-lpyrrolo[3,4-c]pyrrol-1,3-dione
Alternate Name(s) anti-endo 4-ethoxycarbonyl-1,3,3a,4,6,6a-hexahydro-2-(4-methylphenyl)-5-methyl-6-ethyl-2H,5H-pyrrolo[3,4-c]pyrrol-1,3-dione ethyl 3-ethyl-2-methyl-5-(4-methylphenyl)-4,6-dioxooctahydropyrrolo[3,4-c]pyrrole-1-carboxylate
CAS Registry Number 111098-89-6
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24N2O4
InChI InChI=1S/C19H24N2O4/c1-5-13-14-15(16(20(13)4)19(24)25-6-2)18(23)21(17(14)22)12-9-7-11(3)8-10-12/h7-10,13-16H,5-6H2,1-4H3
InChIKey HOLUPEUXIPLRIG-UHFFFAOYSA-N
Molecular Weight 344.411 g/mol
SMILES C12C(C(=O)N(C2=O)c2ccc(cc2)C)C(CC)N(C1C(=O)OCC)C
SPLASH splash10-00di-0090000000-fb2632ae64d1a4d3475c
Source of Spectrum AJ-60-4073-4
Wiley ID 1337938