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2-(cyclopentylthio)-5-methyl-6-veratryl-1H-pyrimidin-4-one
SpectraBase Compound ID 7FTRzrSjIyS
InChI InChI=1S/C19H24N2O3S/c1-12-15(10-13-8-9-16(23-2)17(11-13)24-3)20-19(21-18(12)22)25-14-6-4-5-7-14/h8-9,11,14H,4-7,10H2,1-3H3,(H,20,21,22)
InChIKey ACCAMVGYQMFHCH-UHFFFAOYSA-N
Mol Weight 360.47 g/mol
Molecular Formula C19H24N2O3S
Exact Mass 360.150764 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gm2AtF6eV5m
Name 2-(cyclopentylthio)-5-methyl-6-veratryl-1H-pyrimidin-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24N2O3S
InChI InChI=1S/C19H24N2O3S/c1-12-15(10-13-8-9-16(23-2)17(11-13)24-3)20-19(21-18(12)22)25-14-6-4-5-7-14/h8-9,11,14H,4-7,10H2,1-3H3,(H,20,21,22)
InChIKey ACCAMVGYQMFHCH-UHFFFAOYSA-N
Molecular Weight 360.472 g/mol
SMILES N1C(C(=C(N=C1SC1CCCC1)Cc1cc(OC)c(cc1)OC)C)=O
SPLASH splash10-01t9-0119000000-50b9ca0c822359dc05b1
Source of Spectrum SK-32-1372-5
Synonyms 2-(cyclopentylthio)-6-[(3,4-dimethoxyphenyl)methyl]-5-methyl-1H-pyrimidin-4-one 2-cyclopentylsulfanyl-6-[(3,4-dimethoxyphenyl)methyl]-5-methyl-1H-pyrimidin-4-one
Wiley ID 1548716