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1,5,6,7,8,9-hexahydrocyclohepta[d]pyrimidine-2,4-dione
SpectraBase Compound ID 1pV3PtLhqEF
InChI InChI=1S/C9H12N2O2/c12-8-6-4-2-1-3-5-7(6)10-9(13)11-8/h1-5H2,(H2,10,11,12,13)
InChIKey PXILTEYPVYROAH-UHFFFAOYSA-N
Mol Weight 180.21 g/mol
Molecular Formula C9H12N2O2
Exact Mass 180.089878 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JE7qtqW54Lb
Name 1,5,6,7,8,9-hexahydrocyclohepta[d]pyrimidine-2,4-dione
Alternate Name(s) 1,5,6,7,8,9-hexahydrocyclohepta[d]pyrimidine-2,4-quinone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H12N2O2
InChI InChI=1S/C9H12N2O2/c12-8-6-4-2-1-3-5-7(6)10-9(13)11-8/h1-5H2,(H2,10,11,12,13)
InChIKey PXILTEYPVYROAH-UHFFFAOYSA-N
Molecular Weight 180.207 g/mol
SMILES N1C(NC=2CCCCCC2C1=O)=O
SPLASH splash10-0uyi-0900000000-f125b580b2e4ceca00ea
Source of Spectrum F-52-7980-9
Wiley ID 796961