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Phosphorin, 4-(4-fluorophenyl)-1,1-dihydro-1-methyl-2,6-diphenyl-1-(2-propynyloxy)-
SpectraBase Compound ID IdpJbtFiuCD
InChI InChI=1S/C27H22FOP/c1-3-18-29-30(2)26(22-10-6-4-7-11-22)19-24(21-14-16-25(28)17-15-21)20-27(30)23-12-8-5-9-13-23/h1,4-17,19-20H,18H2,2H3
InChIKey NAWIDLMHBZNYAK-UHFFFAOYSA-N
Mol Weight 412.44 g/mol
Molecular Formula C27H22FOP
Exact Mass 412.13923 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mPnCaAu7MO
Name Phosphorin, 4-(4-fluorophenyl)-1,1-dihydro-1-methyl-2,6-diphenyl-1-(2-propynyloxy)-
CAS Registry Number 78336-74-0
Comments Less than 3 mono-isotopic peaks
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Formula C27H22FOP
InChI InChI=1S/C27H22FOP/c1-3-18-29-30(2)26(22-10-6-4-7-11-22)19-24(21-14-16-25(28)17-15-21)20-27(30)23-12-8-5-9-13-23/h1,4-17,19-20H,18H2,2H3
InChIKey NAWIDLMHBZNYAK-UHFFFAOYSA-N
Molecular Weight 412.444 g/mol
SMILES c1(p(c(cc(c1)-c1ccc(cc1)F)-c1ccccc1)(OCC#C)C)-c1ccccc1
SPLASH splash10-08fr-0800900000-63e5c5dc5b00b5183a2d
Source of Spectrum K-114-1761-0
Synonyms 4-(4-fluorophenyl)-1-methyl-2,6-diphenyl-1-(2-propynyloxy)-1lambda(5)-phosphorin 4-(4-Fluorophenyl)-1-methyl-2,6-diphenyl-1-propargyloxy-.lambda.5-phosphorine
Wiley ID 1374624