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1,3,6-Trimethylcyclooctapyrimidine-2,4-dione

View entire compound with spectra: 1 MS (GC)

1,3,6-Trimethylcyclooctapyrimidine-2,4-dione
SpectraBase Compound ID LZ2dp86gbZp
InChI InChI=1S/C13H14N2O2/c1-9-6-4-5-7-11-10(8-9)12(16)15(3)13(17)14(11)2/h4-8H,1-3H3/b5-4-,6-4-,7-5-,9-6-,9-8-,10-8+,11-7+
InChIKey GKJBFIWHZKJARA-NHRWZAFJSA-N
Mol Weight 230.27 g/mol
Molecular Formula C13H14N2O2
Exact Mass 230.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5wuPCehcEa6
Name 1,3,6-Trimethylcyclooctapyrimidine-2,4-dione
Alternate Name(s) 1,3,6-trimethylcycloocta[d]pyrimidine-2,4(1H,3H)-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O2
InChI InChI=1S/C13H14N2O2/c1-9-6-4-5-7-11-10(8-9)12(16)15(3)13(17)14(11)2/h4-8H,1-3H3/b5-4-,6-4-,7-5-,9-6-,9-8-,10-8+,11-7+
InChIKey GKJBFIWHZKJARA-NHRWZAFJSA-N
Molecular Weight 230.267 g/mol
SMILES C1(\C=2\C(N(C(N1C)=O)C)=C/C=C\C=C/(C\2)C)=O
SPLASH splash10-001i-0590000000-7ad351751779e6dc27d6
Source of Spectrum E1-41-242-4
Wiley ID 1551910