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N-Benzyl-N-(6-(diphenylphosphoryl)cyclohex-2-en-1-yl)-acetamide
SpectraBase Compound ID 7TwEFDhqiMT
InChI InChI=1S/C27H28NO2P/c1-22(29)28(21-23-13-5-2-6-14-23)26-19-11-12-20-27(26)31(30,24-15-7-3-8-16-24)25-17-9-4-10-18-25/h2-11,13-19,26-27H,12,20-21H2,1H3
InChIKey XXYQSXUNNAARRN-UHFFFAOYSA-N
Mol Weight 429.5 g/mol
Molecular Formula C27H28NO2P
Exact Mass 429.185766 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KmBoeJLBDqz
Name N-Benzyl-N-(6-(diphenylphosphoryl)cyclohex-2-en-1-yl)-acetamide
Appearance White wax
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Exact Mass 429.185766142 u
Formula C27H28NO2P
GC Column DB-5 (30 m x 0.25 mm)
InChI InChI=1S/C27H28NO2P/c1-22(29)28(21-23-13-5-2-6-14-23)26-19-11-12-20-27(26)31(30,24-15-7-3-8-16-24)25-17-9-4-10-18-25/h2-11,13-19,26-27H,12,20-21H2,1H3
InChIKey XXYQSXUNNAARRN-UHFFFAOYSA-N
Instrument Name GCMS
Ionization Type EI
Literature Reference DOI 10.1021/jo4001788
Molecular Weight 429.500 g/mol
Reported Formula C27H28NO2P
SMILES C1(=CC=CC=C1)CN(C(C)=O)C1C=CCCC1P(=O)(C1=CC=CC=C1)C1=CC=CC=C1
SPLASH splash10-0udi-0190000000-b0f753dedebddf46a0a8
Source of Spectrum JOC-78-4728-22b (DOI: 10.1021/jo4001788)
Wiley ID 1912116