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Butyl 2-[6-amino-2-(2-butoxy-2-oxo-ethyl)sulfanyl-4-oxo-pyrimidin-1-yl]acetate
SpectraBase Compound ID HernMySvo4e
InChI InChI=1S/C16H25N3O5S/c1-3-5-7-23-14(21)10-19-12(17)9-13(20)18-16(19)25-11-15(22)24-8-6-4-2/h9H,3-8,10-11,17H2,1-2H3
InChIKey ZCCDQEGNKDDYKQ-UHFFFAOYSA-N
Mol Weight 371.45 g/mol
Molecular Formula C16H25N3O5S
Exact Mass 371.151492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 82MeIEzWrE0
Name Butyl 2-[6-amino-2-(2-butoxy-2-oxo-ethyl)sulfanyl-4-oxo-pyrimidin-1-yl]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25N3O5S
InChI InChI=1S/C16H25N3O5S/c1-3-5-7-23-14(21)10-19-12(17)9-13(20)18-16(19)25-11-15(22)24-8-6-4-2/h9H,3-8,10-11,17H2,1-2H3
InChIKey ZCCDQEGNKDDYKQ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/rcm.1122
Molecular Weight 371.452 g/mol
SMILES NC1=CC(=O)N=C(N1CC(=O)OCCCC)SCC(=O)OCCCC
SPLASH splash10-00xs-5592000000-64726fee7cdf9326ccdd
Source of Spectrum RCM-17-1920-16
Synonyms Butyl 2-((6-amino-1-(2-butoxy-2-oxoethyl)-4-oxo-1,4-dihydropyrimidin-2-yl)thio)acetate
Wiley ID 1819893