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(2E,3E)-N-isopropyl-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-imine oxide
SpectraBase Compound ID FGTRgyVzMj6
InChI InChI=1S/C16H27NO/c1-12(2)17(18)14(4)9-10-15-13(3)8-7-11-16(15,5)6/h9-10,12H,7-8,11H2,1-6H3/b10-9+,17-14-
InChIKey RKEMUHLXKZGNJZ-BBFBKMQUSA-N
Mol Weight 249.4 g/mol
Molecular Formula C16H27NO
Exact Mass 249.209264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IJea6yH4KDx
Name (2E,3E)-N-isopropyl-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-imine oxide
Appearance White solid
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Exact Mass 249.209264492 u
Formula C16H27NO
InChI InChI=1S/C16H27NO/c1-12(2)17(18)14(4)9-10-15-13(3)8-7-11-16(15,5)6/h9-10,12H,7-8,11H2,1-6H3/b10-9+,17-14-
InChIKey RKEMUHLXKZGNJZ-BBFBKMQUSA-N
Instrument Name Agilent 6890 N and MSD 5975
Ionization Type EI
Molecular Weight 249.398 g/mol
Quality 132
SMILES C(\[N+](=C/(C)\C=C\C1=C(CCCC1(C)C)C)[O-])(C)C
SPLASH splash10-0006-0900000000-3480e6e9520185c3332a
Source of Spectrum WO2022263605A1
Wiley ID 1892744