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N-(2-Adamantan-1-yl-ethyl)-2-(4-hydroxy-6-propyl-pyrimidin-2-ylsulfanyl)-acetamide
SpectraBase Compound ID rQF9rWnL3b
InChI InChI=1S/C21H31N3O2S/c1-2-3-17-9-18(25)24-20(23-17)27-13-19(26)22-5-4-21-10-14-6-15(11-21)8-16(7-14)12-21/h9,14-16H,2-8,10-13H2,1H3,(H,22,26)(H,23,24,25)
InChIKey RPRJYFYTEDPIGJ-UHFFFAOYSA-N
Mol Weight 389.56 g/mol
Molecular Formula C21H31N3O2S
Exact Mass 389.213698 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DIwxc6F1sGV
Name N-(2-Adamantan-1-yl-ethyl)-2-(4-hydroxy-6-propyl-pyrimidin-2-ylsulfanyl)-acetamide
Alternate Name(s) N-[2-(1-adamantyl)ethyl]-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]acetamide N-[2-(1-adamantyl)ethyl]-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]ethanamide N-[2-(1-adamantyl)ethyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]acetamide N-[2-(1-adamantyl)ethyl]-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H31N3O2S
InChI InChI=1S/C21H31N3O2S/c1-2-3-17-9-18(25)24-20(23-17)27-13-19(26)22-5-4-21-10-14-6-15(11-21)8-16(7-14)12-21/h9,14-16H,2-8,10-13H2,1H3,(H,22,26)(H,23,24,25)
InChIKey RPRJYFYTEDPIGJ-UHFFFAOYSA-N
Molecular Weight 389.558 g/mol
SMILES N(C(CSc1nc(cc(n1)CCC)O)=O)CCC12CC3CC(C2)CC(C1)C3
SPLASH splash10-000l-7921000000-2ea19ee9093624abb0ce
Wiley ID 1466448