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DFUGJTBMQKRCPI-UHFFFAOYSA-N
SpectraBase Compound ID h8S7qksfnW
InChI InChI=1S/C6H9N3O3/c1-10-4-7-5(11-2)9-6(8-4)12-3/h1-3H3
InChIKey DFUGJTBMQKRCPI-UHFFFAOYSA-N
Mol Weight 171.16 g/mol
Molecular Formula C6H9N3O3
Exact Mass 171.064391 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JgGXIrR4ZYE
Name Urea artifact 3ME
Classification Biomolecule
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Exact Mass 171.064391159 u
Formula C6H9N3O3
InChI InChI=1S/C6H9N3O3/c1-10-4-7-5(11-2)9-6(8-4)12-3/h1-3H3
InChIKey DFUGJTBMQKRCPI-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 171.156 g/mol
SMILES COc1nc(nc(OC)n1)OC
SPLASH splash10-05fr-9800000000-0997242d83fc278deacd
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Cyanuric acid 3ME
Technique GC/MS
Wiley ID MMPW6e_10546