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5-(DIMETHYLAMINO)-3,4-DIHYDRO-4,4-DIMETHYL-2-OXO-2H-IMIDAZOLINO-TRIFLUORO-THIOACETAMIDATE
SpectraBase Compound ID 6qYacM23gBS
InChI InChI=1S/C9H13F3N4OS/c1-8(2)6(15(3)4)16(7(17)13-8)14-5(18)9(10,11)12/h1-4H3,(H-,13,14,17,18)
InChIKey VRDOADOVWDSUBD-UHFFFAOYSA-N
Mol Weight 282.29 g/mol
Molecular Formula C9H13F3N4OS
Exact Mass 282.076217 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F1QfELDMw6n
Name 1H-Imidazolium, 4-(dimethylamino)-2,5-dihydro-5,5-dimethyl-2-oxo-3-[(2,2,2-trifluoro-1-thioxoethyl)amino]-, hydroxide, inner salt
CAS Registry Number 128945-29-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13F3N4OS
InChI InChI=1S/C9H13F3N4OS/c1-8(2)6(15(3)4)16(7(17)13-8)14-5(18)9(10,11)12/h1-4H3,(H-,13,14,17,18)
InChIKey VRDOADOVWDSUBD-UHFFFAOYSA-N
Molecular Weight 282.285 g/mol
SMILES N([N+]=1C([N-]C(C1N(C)C)(C)C)=O)C(C(F)(F)F)=S
SPLASH splash10-006y-9200000000-73f05c77dda56b064af2
Source of Spectrum H-73-503-6
Synonyms 4-(dimethylamino)-5,5-dimethyl-2-oxo-3-(2,2,2-trifluoroethanethioamido)-2,5-dihydro-1H-imidazol-3-ium-1-ide 5-(dimethyl-amino)-3,4-dihydro-4,4-dimethyl-2-oxo-2H-imidazolium-trifluorothioacetamidate
Wiley ID 1285280