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3a-bromo-3a,8b-dihydro-3-phenyl-1,1,5-trimethyl-1H-pyrrolo[3',4':4,5]thieno[2,3-c]pyridine, 4,4-dioxide
SpectraBase Compound ID 1iVFwRDEkaP
InChI InChI=1S/C18H17BrN2O2S/c1-11-14-13(9-10-20-11)15-17(2,3)21-16(12-7-5-4-6-8-12)18(15,19)24(14,22)23/h4-10,15H,1-3H3
InChIKey ZPKJTNHUKVDUJN-UHFFFAOYSA-N
Mol Weight 405.31 g/mol
Molecular Formula C18H17BrN2O2S
Exact Mass 404.019412 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 5dWw7nZtirk
Name 3a-BROMO-3a,8b-DIHYDRO-3-PHENYL-1,1,5-TRIMETHYL-1H-PYRROLO[3',4':4,5]THIENO[2,3-c]PYRIDINE, 4,4-DIOXIDE
Source of Sample U. Fischer, F. Hoffmann-La Roche & Company, Ltd., Basel, Switzerland
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H17BrN2O2S
InChI InChI=1S/C18H17BrN2O2S/c1-11-14-13(9-10-20-11)15-17(2,3)21-16(12-7-5-4-6-8-12)18(15,19)24(14,22)23/h4-10,15H,1-3H3
InChIKey ZPKJTNHUKVDUJN-UHFFFAOYSA-N
Literature Reference HELV. CHIM. ACTA 66, 971(1983) Abstract-Chemical Abstracts= 99, 105144X(1983)
Melting Point 147.5-148.5C
Molecular Weight 405.316010
Synonyms 1H-PYRROLO/3*,4*:4,5/THIENO/2,3-C/- PYRIDINE, 3A-BROMO-3A,8B-DIHYDRO- 3-PHENYL-1,1,5-TRIMETHYL-, 4,4-DIOXIDE
Technique KBr WAFER