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2-Methylthio-6-n-butyl-5,6-dihydropyrimidine-4(3H)-one
SpectraBase Compound ID CZJQaPRfqZu
InChI InChI=1S/C9H16N2OS/c1-3-4-5-7-6-8(12)11-9(10-7)13-2/h7H,3-6H2,1-2H3,(H,10,11,12)
InChIKey LWVRUTSFOURGCG-UHFFFAOYSA-N
Mol Weight 200.3 g/mol
Molecular Formula C9H16N2OS
Exact Mass 200.098334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2ea47YHKu8C
Name 2-Methylthio-6-n-butyl-5,6-dihydropyrimidine-4(3H)-one
Alternate Name(s) 6-butyl-2-(methylsulfanyl)-5,6-dihydro-4(3H)-pyrimidinone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16N2OS
InChI InChI=1S/C9H16N2OS/c1-3-4-5-7-6-8(12)11-9(10-7)13-2/h7H,3-6H2,1-2H3,(H,10,11,12)
InChIKey LWVRUTSFOURGCG-UHFFFAOYSA-N
Molecular Weight 200.300 g/mol
SMILES N1C(CC(N=C1SC)CCCC)=O
SPLASH splash10-0006-0920000000-3de10a87b69ce05ef8d5
Source of Spectrum SO-0-580-5
Wiley ID 1539404