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1,3-Diazatricyclo[3.3.1.1(3,7)]decan-6-one, 5-butyl-7-methyl-2-(5-nitro-2-furanyl)-
SpectraBase Compound ID 1sJnYAMvk94
InChI InChI=1S/C17H23N3O4/c1-3-4-7-17-10-18-8-16(2,15(17)21)9-19(11-17)14(18)12-5-6-13(24-12)20(22)23/h5-6,14H,3-4,7-11H2,1-2H3/t14?,16-,17+
InChIKey ZYWXANNVIRPTCP-ZXFUBFMLSA-N
Mol Weight 333.39 g/mol
Molecular Formula C17H23N3O4
Exact Mass 333.168856 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9bNPMa15vU1
Name 1,3-Diazatricyclo[3.3.1.1(3,7)]decan-6-one, 5-butyl-7-methyl-2-(5-nitro-2-furanyl)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23N3O4
InChI InChI=1S/C17H23N3O4/c1-3-4-7-17-10-18-8-16(2,15(17)21)9-19(11-17)14(18)12-5-6-13(24-12)20(22)23/h5-6,14H,3-4,7-11H2,1-2H3/t14?,16-,17+
InChIKey ZYWXANNVIRPTCP-ZXFUBFMLSA-N
Molecular Weight 333.388 g/mol
SMILES CCCC[C@]12CN3C[C@@](C2=O)(CN(C1)C3c1ccc(o1)N(=O)=O)C
SPLASH splash10-0006-9420000000-c7089400133b34594986
Source of Spectrum IY-2-4997-3
Synonyms 5-Butyl-7-methyl-2-(5-nitrofuran-2-yl)-1,3-diazatricyclo[3.3.1.1(3,7)]decan-6-one
Wiley ID 1657956