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(3,5-Dinitro-phenyl)-(1,1-dioxo-thiomorpholin-4-yl)-methanone
SpectraBase Compound ID I1wIS12fyHk
InChI InChI=1S/C11H11N3O7S/c15-11(12-1-3-22(20,21)4-2-12)8-5-9(13(16)17)7-10(6-8)14(18)19/h5-7H,1-4H2
InChIKey XRQHUJBTXKCLHW-UHFFFAOYSA-N
Mol Weight 329.28 g/mol
Molecular Formula C11H11N3O7S
Exact Mass 329.031771 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H8tvgFoXKkN
Name (3,5-Dinitro-phenyl)-(1,1-dioxo-thiomorpholin-4-yl)-methanone
Alternate Name(s) (1,1-diketo-1,4-thiazinan-4-yl)-(3,5-dinitrophenyl)methanone (3,5-dinitrophenyl)-(1,1-dioxo-1,4-thiazinan-4-yl)methanone 4-(3,5-Dinitrobenzoyl)thiomorpholine 1,1-dioxide [1,1-bis(oxidanylidene)-1,4-thiazinan-4-yl]-(3,5-dinitrophenyl)methanone
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Formula C11H11N3O7S
InChI InChI=1S/C11H11N3O7S/c15-11(12-1-3-22(20,21)4-2-12)8-5-9(13(16)17)7-10(6-8)14(18)19/h5-7H,1-4H2
InChIKey XRQHUJBTXKCLHW-UHFFFAOYSA-N
Molecular Weight 329.283 g/mol
SMILES C(c1cc(cc(c1)N(=O)=O)N(=O)=O)(=O)N1CCS(CC1)(=O)=O
SPLASH splash10-0002-3950000000-dabfeb61f902489aacbf
Wiley ID 1462666