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5-Ethoxycarbonyl-6-methyl-3-(3-methylphenyl)-2-(piperidin-1-yl)furo[2,3-d]pyrimidin-4(3H)-one
SpectraBase Compound ID AmITZT4RI3H
InChI InChI=1S/C22H25N3O4/c1-4-28-21(27)17-15(3)29-19-18(17)20(26)25(16-10-8-9-14(2)13-16)22(23-19)24-11-6-5-7-12-24/h8-10,13H,4-7,11-12H2,1-3H3
InChIKey RTODQTPXNNQTKG-UHFFFAOYSA-N
Mol Weight 395.46 g/mol
Molecular Formula C22H25N3O4
Exact Mass 395.184506 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID OwFDkFSK5k
Name 5-Ethoxycarbonyl-6-methyl-3-(3-methylphenyl)-2-(piperidin-1-yl)furo[2,3-d]pyrimidin-4(3H)-one
Appearance White crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H25N3O4
InChI InChI=1S/C22H25N3O4/c1-4-28-21(27)17-15(3)29-19-18(17)20(26)25(16-10-8-9-14(2)13-16)22(23-19)24-11-6-5-7-12-24/h8-10,13H,4-7,11-12H2,1-3H3
InChIKey RTODQTPXNNQTKG-UHFFFAOYSA-N
Instrument Name Finnigan Trace
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0009.d18
Molecular Weight 395.459 g/mol
SMILES C(C)OC(=O)c1c(oc2N=C(N(C(c12)=O)c1cc(ccc1)C)N1CCCCC1)C
SPLASH splash10-0ukd-6796000000-3a4b1b4cf8f9edb2e4a6
Source of Spectrum ARK-2008-155-6d
Wiley ID 1869108