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2,3-Dihydrobenzo[1,4]dioxine-6-sulfonic acid, (1,3,5-trimethyl-1H-pyrazol-4-yl)amide
SpectraBase Compound ID KL2eO6hfzES
InChI InChI=1S/C14H17N3O4S/c1-9-14(10(2)17(3)15-9)16-22(18,19)11-4-5-12-13(8-11)21-7-6-20-12/h4-5,8,16H,6-7H2,1-3H3
InChIKey LMDSSLFOHMBAEK-UHFFFAOYSA-N
Mol Weight 323.37 g/mol
Molecular Formula C14H17N3O4S
Exact Mass 323.093977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CD8psnAVEGK
Name 2,3-Dihydrobenzo[1,4]dioxine-6-sulfonic acid, (1,3,5-trimethyl-1H-pyrazol-4-yl)amide
Alternate Name(s) N-(1,3,5-trimethyl-1H-pyrazol-4-yl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide N-(1,3,5-trimethyl-4-pyrazolyl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide N-(1,3,5-trimethylpyrazol-4-yl)-2,3-dihydro-1,4-benzodioxin-6-sulfonamide N-(1,3,5-trimethylpyrazol-4-yl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
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Formula C14H17N3O4S
InChI InChI=1S/C14H17N3O4S/c1-9-14(10(2)17(3)15-9)16-22(18,19)11-4-5-12-13(8-11)21-7-6-20-12/h4-5,8,16H,6-7H2,1-3H3
InChIKey LMDSSLFOHMBAEK-UHFFFAOYSA-N
Molecular Weight 323.367 g/mol
SMILES N(S(c1cc2OCCOc2cc1)(=O)=O)c1c([n](C)nc1C)C
SPLASH splash10-05fr-9700000000-b3ee201fe50e53d3d205
Wiley ID 1447714