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1,8-Diazatricyclo[9.6.1.0(12,17)]octadeca-11(18),12,14,16-tetraen-7-one dimer
SpectraBase Compound ID 7DzvsDGDq2s
InChI InChI=1S/C32H40N4O2/c37-31-15-3-1-9-21-35-23-25(27-11-5-7-13-29(27)35)18-20-34-32(38)16-4-2-10-22-36-24-26(17-19-33-31)28-12-6-8-14-30(28)36/h5-8,11-14,23-24H,1-4,9-10,15-22H2,(H,33,37)(H,34,38)
InChIKey DCQGGSRQAIGSHA-UHFFFAOYSA-N
Mol Weight 512.7 g/mol
Molecular Formula C32H40N4O2
Exact Mass 512.315127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 92UYTxfhyi1
Name 1,8-Diazatricyclo[9.6.1.0(12,17)]octadeca-11(18),12,14,16-tetraen-7-one dimer
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Formula C32H40N4O2
InChI InChI=1S/C32H40N4O2/c37-31-15-3-1-9-21-35-23-25(27-11-5-7-13-29(27)35)18-20-34-32(38)16-4-2-10-22-36-24-26(17-19-33-31)28-12-6-8-14-30(28)36/h5-8,11-14,23-24H,1-4,9-10,15-22H2,(H,33,37)(H,34,38)
InChIKey DCQGGSRQAIGSHA-UHFFFAOYSA-N
Molecular Weight 512.698 g/mol
SMILES N1CCc2c[n](CCCCCC(NCCc3c[n](CCCCCC1=O)c1c3cccc1)=O)c1c2cccc1
SPLASH splash10-0a4i-0690010000-edc9081716f5d6346971
Source of Spectrum SO-0-1697-10
Wiley ID 878601