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N-(1-methyloctahydro-3,5-methanocyclopenta[b]pyrrol-6-yl)-5-sulfamoyl-o-anisamide, fumarate(2.1)

View entire compound with spectra: 1 NMR, and 1 FTIR

N-(1-methyloctahydro-3,5-methanocyclopenta[b]pyrrol-6-yl)-5-sulfamoyl-o-anisamide, fumarate(2.1)
SpectraBase Compound ID CJk54cnshmH
InChI InChI=1S/2C17H23N3O4S.C4H4O4/c2*1-20-8-10-5-9-6-12(10)16(20)15(9)19-17(21)13-7-11(25(18,22)23)3-4-14(13)24-2;5-3(6)1-2-4(7)8/h2*3-4,7,9-10,12,15-16H,5-6,8H2,1-2H3,(H,19,21)(H2,18,22,23);1-2H,(H,5,6)(H,7,8)/b;;2-1+/t2*9-,10-,12-,15-,16+;/m00./s1
InChIKey WVOSDZBFIYQFDS-NMVHZCBQSA-N
Mol Weight 846.97 g/mol
Molecular Formula C38H50N6O12S2
Exact Mass 846.292813 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID HcLlWC926Fz
Name N-(1-METHYLOCTAHYDRO-3,5-METHANOCYCLOPENTA[b]PYRROL-6-YL)-5-SULFAMOYL-o-ANISAMIDE, FUMARATE (2:1)
Source of Sample M. Langlois, Delalande Research Center, Rueil-Malmaison, France
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C38H50N6O12S2
InChI InChI=1S/2C17H23N3O4S.C4H4O4/c2*1-20-8-10-5-9-6-12(10)16(20)15(9)19-17(21)13-7-11(25(18,22)23)3-4-14(13)24-2;5-3(6)1-2-4(7)8/h2*3-4,7,9-10,12,15-16H,5-6,8H2,1-2H3,(H,19,21)(H2,18,22,23);1-2H,(H,5,6)(H,7,8)/b;;2-1+/t2*9-,10-,12-,15-,16+;/m00./s1
InChIKey WVOSDZBFIYQFDS-NMVHZCBQSA-N
Literature Reference EUR. J. MED. CHEM. 17, 445(1982) Abstract-Chemical Abstracts= 98, 71860Q(1983)
Melting Point 224C
Molecular Weight 846.968018
Synonyms O-ANISAMIDE, N-/1-METHYLOCTAHYDRO- 3,5-METHANOCYCLOPENTA/B/PYRROL-6-YL/- 5-SULFAMOYL-, FUMARATE /2 TO 1/ O-ANISAMIDE, N-/1-METHYLOCTAHYDRO- 3,5-METHANOCYCLOPENTA/B/PYRROL-6-YL/- 5-SYLFAMOYL-, FUMARATE /2 TO 1/
Technique KBr WAFER