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6-(3,4,5-Trichlorophenyl)-5H-pyrrolo[3,4-b]pyrazine-5,7(6H)-dione

View entire compound with spectra: 1 MS (GC)

6-(3,4,5-Trichlorophenyl)-5H-pyrrolo[3,4-b]pyrazine-5,7(6H)-dione
SpectraBase Compound ID ELwtdbAFgIL
InChI InChI=1S/C12H4Cl3N3O2/c13-6-3-5(4-7(14)8(6)15)18-11(19)9-10(12(18)20)17-2-1-16-9/h1-4H
InChIKey YMNSMFPTKNHFBB-UHFFFAOYSA-N
Mol Weight 328.54 g/mol
Molecular Formula C12H4Cl3N3O2
Exact Mass 326.936909 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 293NR6dJ35j
Name 6-(3,4,5-Trichlorophenyl)-5H-pyrrolo[3,4-b]pyrazine-5,7(6H)-dione
Alternate Name(s) 6-(3,4,5-trichlorophenyl)pyrrolo[3,4-b]pyrazine-5,7-dione 6-[3,4,5-tris(chloranyl)phenyl]pyrrolo[3,4-b]pyrazine-5,7-dione
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H4Cl3N3O2
InChI InChI=1S/C12H4Cl3N3O2/c13-6-3-5(4-7(14)8(6)15)18-11(19)9-10(12(18)20)17-2-1-16-9/h1-4H
InChIKey YMNSMFPTKNHFBB-UHFFFAOYSA-N
Molecular Weight 328.542 g/mol
SMILES C1(N(C(c2nccnc12)=O)c1cc(Cl)c(c(c1)Cl)Cl)=O
SPLASH splash10-004i-0009000000-9f3f0927f584e3c7cbe1
Source of Spectrum F2-45-1653-3c
Wiley ID 1703423