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5,6,8-TRICHLORO-7-OXO-3,7-DIHYDRO-2H-QUINOXALINE-1-CARBOTHIOIC-ACID-ALLYL-AMIDE

View entire compound with spectra: 2 NMR, and 1 MS (GC)

5,6,8-TRICHLORO-7-OXO-3,7-DIHYDRO-2H-QUINOXALINE-1-CARBOTHIOIC-ACID-ALLYL-AMIDE
SpectraBase Compound ID 4BB3PSxb0tF
InChI InChI=1S/C12H10Cl3N3OS/c1-2-3-17-12(20)18-5-4-16-9-6(13)7(14)11(19)8(15)10(9)18/h2H,1,3-5H2,(H,17,20)
InChIKey CDVJMARPAGAMEP-UHFFFAOYSA-N
Mol Weight 350.65 g/mol
Molecular Formula C12H10Cl3N3OS
Exact Mass 348.961016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EvYlZbHuDy4
Name 5,6,8-trichloro-7-oxo-N-prop-2-enyl-2,3-dihydroquinoxaline-1-carbothioamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10Cl3N3OS
InChI InChI=1S/C12H10Cl3N3OS/c1-2-3-17-12(20)18-5-4-16-9-6(13)7(14)11(19)8(15)10(9)18/h2H,1,3-5H2,(H,17,20)
InChIKey CDVJMARPAGAMEP-UHFFFAOYSA-N
Molecular Weight 350.651 g/mol
SMILES N(C(N1CCN=C2C(=C(C(C(=C12)Cl)=O)Cl)Cl)=S)CC=C
SPLASH splash10-000e-9004000000-419ed1aa834455894eb2
Source of Spectrum AJ-43-474-14
Synonyms 5,6,8-tris(chloranyl)-7-oxidanylidene-N-prop-2-enyl-2,3-dihydroquinoxaline-1-carbothioamide N-allyl-5,6,8-trichloro-7-keto-2,3-dihydroquinoxaline-1-carbothioamide N-allyl-5,6,8-trichloro-7-oxo-2,3-dihydroquinoxaline-1-carbothioamide
Wiley ID 1593999