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4-ethoxy-2-methyl-N-(1-methyloctahydro-3,5-methanocyclopenta[b]pyrrol-6-yl)-5-pyrimidinecraboxamide, fumarate(1.1 1/4)
SpectraBase Compound ID JbSQ3bcGVsg
InChI InChI=1S/4C17H24N4O2.5C4H4O4/c4*1-4-23-17-13(7-18-9(2)19-17)16(22)20-14-10-5-11-8-21(3)15(14)12(11)6-10;5*5-3(6)1-2-4(7)8/h4*7,10-12,14-15H,4-6,8H2,1-3H3,(H,20,22);5*1-2H,(H,5,6)(H,7,8)/b;;;;5*2-1+/t4*10-,11-,12-,14+,15+;;;;;/m0000...../s1
InChIKey UQRGYPKMZAKAEU-GYFLVIMSSA-N
Mol Weight 461.5 g/mol
Molecular Formula C22H29N4O7
Exact Mass 461.203624 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EDFaNXgec3
Name 4-ethoxy-2-methyl-N-(1-methyloctahydro-3,5-methanocyclopenta[b]pyrrol-6-yl)-5-pyrimidinecraboxamide, fumarate(1.1 1/4)
Copyright Copyright © 2009-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H28N4O6
InChI InChI=1S/4C17H24N4O2.5C4H4O4/c4*1-4-23-17-13(7-18-9(2)19-17)16(22)20-14-10-5-11-8-21(3)15(14)12(11)6-10;5*5-3(6)1-2-4(7)8/h4*7,10-12,14-15H,4-6,8H2,1-3H3,(H,20,22);5*1-2H,(H,5,6)(H,7,8)/b;;;;5*2-1+/t4*10-,11-,12-,14+,15+;;;;;/m0000...../s1
InChIKey UQRGYPKMZAKAEU-GYFLVIMSSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 42671M
Solvent Polysol