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5-[(Butylamino)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
SpectraBase Compound ID BmXJHym8b6a
InChI InChI=1S/C9H13N3O3/c1-2-3-4-10-5-6-7(13)11-9(15)12-8(6)14/h5,10H,2-4H2,1H3,(H2,11,12,13,14,15)
InChIKey RYNPELLBQFOMHN-UHFFFAOYSA-N
Mol Weight 211.22 g/mol
Molecular Formula C9H13N3O3
Exact Mass 211.095691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2yBWs8tnsaD
Name 5-[(Butylamino)methylene]-2,4,6(1H,3H,5H)-pyrimidinetrione
CAS Registry Number 346612-00-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13N3O3
InChI InChI=1S/C9H13N3O3/c1-2-3-4-10-5-6-7(13)11-9(15)12-8(6)14/h5,10H,2-4H2,1H3,(H2,11,12,13,14,15)
InChIKey RYNPELLBQFOMHN-UHFFFAOYSA-N
Molecular Weight 211.221 g/mol
SMILES N1C(NC(C(=CNCCCC)C1=O)=O)=O
SPLASH splash10-02cr-6920000000-c4d3be3c611d6d65d329
Source of Spectrum AD-0-2532-0
Synonyms 2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-[(butylamino)methylene]- 5-(butylaminomethylene)barbituric acid 5-(butylaminomethylene)hexahydropyrimidine-2,4,6-trione 5-(butylaminomethylidene)-1,3-diazinane-2,4,6-trione
Wiley ID 1429678