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5-Methyl-5-azatricyclo[7.3.0.0(3,7)]dodeca-8-en-4,6,10-trione
SpectraBase Compound ID 8tIIFveOoGI
InChI InChI=1S/C12H13NO3/c1-13-11(15)8-4-6-2-3-10(14)7(6)5-9(8)12(13)16/h5-6,8-9H,2-4H2,1H3
InChIKey VFQOTOIXMOEBIM-UHFFFAOYSA-N
Mol Weight 219.24 g/mol
Molecular Formula C12H13NO3
Exact Mass 219.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Bm4OUempo6
Name 5-Methyl-5-azatricyclo[7.3.0.0(3,7)]dodeca-8-en-4,6,10-trione
Alternate Name(s) 2-Methyl-3a,6,7,7a,8,8a-hexahydrocyclopenta[f]isoindole-1,3,5(2H)-trione
CAS Registry Number 112091-65-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13NO3
InChI InChI=1S/C12H13NO3/c1-13-11(15)8-4-6-2-3-10(14)7(6)5-9(8)12(13)16/h5-6,8-9H,2-4H2,1H3
InChIKey VFQOTOIXMOEBIM-UHFFFAOYSA-N
Molecular Weight 219.240 g/mol
SMILES C1(N(C(C2CC3CCC(C3=CC12)=O)=O)C)=O
SPLASH splash10-002f-9100000000-faae8de2655b777f67df
Source of Spectrum AJ-60-333-15
Wiley ID 1218841