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(Z)-N-(2-(2-Bromophenyl)propan-2-yl)-1-(phenyl-d5)methanimine oxide-d
SpectraBase Compound ID 6Rqo6Eibixb
InChI InChI=1S/C16H16BrNO/c1-16(2,14-10-6-7-11-15(14)17)18(19)12-13-8-4-3-5-9-13/h3-12H,1-2H3/b18-12-/i3D,4D,5D,8D,9D,12D
InChIKey JAQBVLQPLFEMAP-XMUPMCJVSA-N
Mol Weight 324.25 g/mol
Molecular Formula C16H10D6BrNO
Exact Mass 323.079188 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KFz9jd4UOBw
Name (Z)-N-(2-(2-Bromophenyl)propan-2-yl)-1-(phenyl-d5)methanimine oxide-d
Appearance Colorless oil
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Exact Mass 323.079187614 u
Formula C16H10D6BrNO
InChI InChI=1S/C16H16BrNO/c1-16(2,14-10-6-7-11-15(14)17)18(19)12-13-8-4-3-5-9-13/h3-12H,1-2H3/b18-12-/i3D,4D,5D,8D,9D,12D
InChIKey JAQBVLQPLFEMAP-XMUPMCJVSA-N
Instrument Name Waters AutoSpec Premier
Ionization Type EI
Literature Reference DOI 10.1021/acs.joc.2c02797
Molecular Weight 324.251 g/mol
Quality 41
Reported Formula C16H10NOBrD6
SMILES C1=CC(=C(C=C1)Br)C(\[N+](=C\(C1=C(C(=C(C(=C1[D])[D])[D])[D])[D])[D])[O-])(C)C
SPLASH splash10-014m-0930000000-a43152c6b45d7c5830dd
Source of Spectrum JOC-88-SM16-1a-d6 (DOI: 10.1021/acs.joc.2c02797)
Thin-Layer Chromatography 0.36 (Hexane/EtOAc, 2:1)
Wiley ID 1912647