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3-p-methoxybenzyl-4,5-dimethyl-4-hydroxy-7-methylsulfone-8-cyano-3,4-dihydropyrido[4,3-d]pyrimidine
SpectraBase Compound ID HISLxWZvupz
InChI InChI=1S/C19H20N4O4S/c1-12-16-17(15(9-20)18(22-12)28(4,25)26)21-11-23(19(16,2)24)10-13-5-7-14(27-3)8-6-13/h5-8,11,24H,10H2,1-4H3
InChIKey DYYSGLCVYKOBGH-UHFFFAOYSA-N
Mol Weight 400.45 g/mol
Molecular Formula C19H20N4O4S
Exact Mass 400.120526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KvKV1o1FlPi
Name 3-p-methoxybenzyl-4,5-dimethyl-4-hydroxy-7-methylsulfone-8-cyano-3,4-dihydropyrido[4,3-d]pyrimidine
Appearance White solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20N4O4S
InChI InChI=1S/C19H20N4O4S/c1-12-16-17(15(9-20)18(22-12)28(4,25)26)21-11-23(19(16,2)24)10-13-5-7-14(27-3)8-6-13/h5-8,11,24H,10H2,1-4H3
InChIKey DYYSGLCVYKOBGH-UHFFFAOYSA-N
Ionization Type EI
Molecular Weight 400.453 g/mol
SMILES OC1(c2c(nc(c(c2N=CN1Cc1ccc(cc1)OC)C#N)S(C)(=O)=O)C)C
SPLASH splash10-00dr-3900000000-aada51690c0d76e2c7ad
Source of Spectrum CN101619063A
Wiley ID 1841457