Debug Info

object
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_id
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2lJ7yd6mjNP
spectrumID
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2lJ7yd6mjNP
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specType
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131072
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WMS3X:98031:1
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Mass Spectrum (GC)
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5-n-Pentyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine
SpectraBase Compound ID E4bo8rFn0gs
InChI InChI=1S/C9H14N2O2/c1-2-3-4-5-7-6-10-9(13)11-8(7)12/h6H,2-5H2,1H3,(H2,10,11,12,13)
InChIKey QCRCBPQJIOLDSS-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C9H14N2O2
Exact Mass 182.105528 g/mol
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Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2lJ7yd6mjNP
Name 5-Pentyl-2,4(1H,3H)-pyrimidinedione
CAS Registry Number 57741-78-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H14N2O2
InChI InChI=1S/C9H14N2O2/c1-2-3-4-5-7-6-10-9(13)11-8(7)12/h6H,2-5H2,1H3,(H2,10,11,12,13)
InChIKey QCRCBPQJIOLDSS-UHFFFAOYSA-N
Molecular Weight 182.223 g/mol
SMILES N1C(NC(C(=C1)CCCCC)=O)=O
SPLASH splash10-0059-6900000000-c52b4727ab35e4f9429e
Source of Spectrum W5-1989-13023-1
Synonyms 5-Amyluracil 5-n-Pentyl-2,4-dioxo-1,2,3,4-tetrahydropyrimidine 5-Pentyl-1H-pyrimidine-2,4-dione
Wiley ID 1178251
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