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3,4-Dihydro-5-[3',4'-dihydro-1-(phenylethyn)naphthalen-2'-yl]-3-phenyl-2H-pyrrole - 1-oxide
SpectraBase Compound ID G3ZcYl6tsL4
InChI InChI=1S/C28H23NO/c30-29-20-24(22-11-5-2-6-12-22)19-28(29)27-18-16-23-13-7-8-14-25(23)26(27)17-15-21-9-3-1-4-10-21/h1-14,24H,16,18-20H2
InChIKey XPQVVEAWFDJOQJ-UHFFFAOYSA-N
Mol Weight 389.5 g/mol
Molecular Formula C28H23NO
Exact Mass 389.177964 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DxF986f4Db
Name 3,4-Dihydro-5-[3',4'-dihydro-1-(phenylethyn)naphthalen-2'-yl]-3-phenyl-2H-pyrrole - 1-oxide
Alternate Name(s) 1-Oxido-3-phenyl-5-[1-(2-phenylethynyl)-3,4-dihydronaphthalen-2-yl]-3,4-dihydro-2H-pyrrol-1-ium 1-Oxidanidyl-3-phenyl-5-[1-(2-phenylethynyl)-3,4-dihydronaphthalen-2-yl]-3,4-dihydro-2H-pyrrol-1-ium
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Formula C28H23NO
InChI InChI=1S/C28H23NO/c30-29-20-24(22-11-5-2-6-12-22)19-28(29)27-18-16-23-13-7-8-14-25(23)26(27)17-15-21-9-3-1-4-10-21/h1-14,24H,16,18-20H2
InChIKey XPQVVEAWFDJOQJ-UHFFFAOYSA-N
Molecular Weight 389.498 g/mol
SMILES C1(=[N+](CC(C1)c1ccccc1)[O-])C1=C(C#Cc2ccccc2)c2c(cccc2)CC1
SPLASH splash10-00di-0009000000-b4a816be21a4af559934
Source of Spectrum U-1996-1861-16
Wiley ID 769198