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3,6-DIMETHYL-1-(TETRAHYDRO-3-THIENYL)-1H-PYRAZOLO[3,4-b]QUINOLINE, S,S-DIOXIDE, COMPOUND WITH DIOXANE
SpectraBase Compound ID GKperGEawcM
InChI InChI=1S/C16H17N3O2S.C4H8O2/c1-10-3-4-15-12(7-10)8-14-11(2)18-19(16(14)17-15)13-5-6-22(20,21)9-13;1-2-6-4-3-5-1/h3-4,7-8,13H,5-6,9H2,1-2H3;1-4H2
InChIKey BVMUCFXYVSWXFL-UHFFFAOYSA-N
Mol Weight 403.5 g/mol
Molecular Formula C20H25N3O4S
Exact Mass 403.156577 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 5RuuB92LrQV
Name 3,6-DIMETHYL-1-(TETRAHYDRO-3-THIENYL)-1H-PYRAZOLO[3,4-b]QUINOLINE, S,S-DIOXIDE, COMPOUND WITH DIOXANE
Source of Sample A. Brack, Bayer AG, Leverkusen, Germany
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H25N3O4S
InChI InChI=1S/C16H17N3O2S.C4H8O2/c1-10-3-4-15-12(7-10)8-14-11(2)18-19(16(14)17-15)13-5-6-22(20,21)9-13;1-2-6-4-3-5-1/h3-4,7-8,13H,5-6,9H2,1-2H3;1-4H2
InChIKey BVMUCFXYVSWXFL-UHFFFAOYSA-N
Literature Reference Abstract-Chemical Abstracts= 62, 11799(1965)
Melting Point 211C
Molecular Weight 403.497009
Synonyms 1H-PYRAZOLO/3,4-B/QUINOLINE, 3,6-DI- METHYL-1-/TETRAHYDRO-3-THIENYL/-, S,S- DIOXIDE, P-DIOXANE SOLVATE /1 TO 1/
Technique KBr WAFER