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3,4,8,9-tetramethyl-12-azatricyclo[4.4.3.0(1,6)]trideca-3,8-dien-11,13-dione
SpectraBase Compound ID J3v0tBFLTed
InChI InChI=1S/C16H21NO2/c1-9-5-15-7-11(3)12(4)8-16(15,6-10(9)2)14(19)17-13(15)18/h5-8H2,1-4H3,(H,17,18,19)/t15-,16+
InChIKey QVICYBPFZHBOOX-IYBDPMFKSA-N
Mol Weight 259.35 g/mol
Molecular Formula C16H21NO2
Exact Mass 259.157229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9StvYqcgJ2x
Name 3,4,8,9-tetramethyl-12-azatricyclo[4.4.3.0(1,6)]trideca-3,8-dien-11,13-dione
Appearance Yellowish solid
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Formula C16H21NO2
InChI InChI=1S/C16H21NO2/c1-9-5-15-7-11(3)12(4)8-16(15,6-10(9)2)14(19)17-13(15)18/h5-8H2,1-4H3,(H,17,18,19)/t15-,16+
InChIKey QVICYBPFZHBOOX-IYBDPMFKSA-N
Instrument Name Hewlett-Packard 5988A
Ionization Type EI
Literature Reference DOI 10.1021/ml500108s
Molecular Weight 259.349 g/mol
SMILES N1C([C@@]23[C@](C1=O)(CC(=C(C3)C)C)CC(=C(C2)C)C)=O
SPLASH splash10-03di-0920000000-ed4597d880ecbd4f1def
Source of Spectrum MCS-5-SM8-10
Wiley ID 1864194