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3-cyclohexyl-6,7-dihydro-1H-cyclopentapyrimidine-2,4(3H,5H)-dione
SpectraBase Compound ID 9JJAlPrmPlT
InChI InChI=1S/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)
InChIKey ZTMKADLOSYKWCA-UHFFFAOYSA-N
Mol Weight 234.3 g/mol
Molecular Formula C13H18N2O2
Exact Mass 234.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JJ1poViM2me
Name Lenacil
CAS Registry Number 2164-08-1
Classification Herbicide
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 234.136827826 u
Formula C13H18N2O2
InChI InChI=1S/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)
InChIKey ZTMKADLOSYKWCA-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 234.299 g/mol
Nominal Mass 234 u
Quality 989
Retention Index 1935
SMILES C1(N(C(NC2=C1CCC2)=O)C1CCCCC1)=O
SPLASH splash10-0udi-3900000000-5ac742fd34f29cb62d57
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 3-Cyclohexyl-3,5-diazabicyclo[4.3.0]non-10-ene-2,4-dione
Technique GC/MS
Wiley ID DD2024_001812