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2-Furancarboxylic acid, 4-(1,2,5,6,7,8-hexahydro-4-hydroxy-7-methylpyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)-2-methoxyphenyl ester

View entire compound with spectra: 1 MS (GC)

2-Furancarboxylic acid, 4-(1,2,5,6,7,8-hexahydro-4-hydroxy-7-methylpyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)-2-methoxyphenyl ester
SpectraBase Compound ID 7nOlXfDaXXz
InChI InChI=1S/C22H21N3O5S/c1-25-8-7-13-17(11-25)31-21-18(13)20(26)23-19(24-21)12-5-6-14(16(10-12)28-2)30-22(27)15-4-3-9-29-15/h3-6,9-10,19,24H,7-8,11H2,1-2H3,(H,23,26)
InChIKey ZEBVGTMJFKNYCW-UHFFFAOYSA-N
Mol Weight 439.49 g/mol
Molecular Formula C22H21N3O5S
Exact Mass 439.120192 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7vdEj2jCe8E
Name 2-Furancarboxylic acid, 4-(1,2,5,6,7,8-hexahydro-4-hydroxy-7-methylpyrido[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)-2-methoxyphenyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21N3O5S
InChI InChI=1S/C22H21N3O5S/c1-25-8-7-13-17(11-25)31-21-18(13)20(26)23-19(24-21)12-5-6-14(16(10-12)28-2)30-22(27)15-4-3-9-29-15/h3-6,9-10,19,24H,7-8,11H2,1-2H3,(H,23,26)
InChIKey ZEBVGTMJFKNYCW-UHFFFAOYSA-N
Molecular Weight 439.486 g/mol
SMILES N1C(N=C(c2c1sc1c2CCN(C)C1)O)c1cc(OC)c(OC(c2occc2)=O)cc1
SPLASH splash10-052b-9301100000-977621096fba342f0177
Source of Spectrum IY-1-4699-8
Wiley ID 1654981