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ETHYL-(4S)-5-METHYL-3-OXO-4-PHTHALIMIDO-2-TRIPHENYL-PHOSPHORANYLIDENE-HEXANOATE
SpectraBase Compound ID It17ISWI2tk
InChI InChI=1S/C35H32NO5P/c1-4-41-35(40)32(31(37)30(24(2)3)36-33(38)28-22-14-15-23-29(28)34(36)39)42(25-16-8-5-9-17-25,26-18-10-6-11-19-26)27-20-12-7-13-21-27/h5-24,30H,4H2,1-3H3/t30-/m0/s1
InChIKey ANHWOIDIPKRDHF-PMERELPUSA-N
Mol Weight 577.6 g/mol
Molecular Formula C35H32NO5P
Exact Mass 577.20181 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L4wzuqCS2Z5
Name (4S)-3-keto-5-methyl-4-phthalimido-2-triphenylphosphoranylidene-hexanoic acid ethyl ester
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Formula C35H32NO5P
InChI InChI=1S/C35H32NO5P/c1-4-41-35(40)32(31(37)30(24(2)3)36-33(38)28-22-14-15-23-29(28)34(36)39)42(25-16-8-5-9-17-25,26-18-10-6-11-19-26)27-20-12-7-13-21-27/h5-24,30H,4H2,1-3H3/t30-/m0/s1
InChIKey ANHWOIDIPKRDHF-PMERELPUSA-N
Molecular Weight 577.617 g/mol
SMILES C1(N(C(c2ccccc12)=O)[C@](C(C(=P(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)OCC)=O)(C(C)C)[H])=O
SPLASH splash10-004i-6849000000-57ff7f28e1a48685a036
Source of Spectrum KC-0-480-12
Synonyms (4S)-4-(1,3-dioxo-2-isoindolyl)-5-methyl-3-oxo-2-triphenylphosphoranylidenehexanoic acid ethyl ester Ethyl (4S)-4-(1,3-dioxoisoindol-2-yl)-5-methyl-3-oxo-2-(triphenyl-$l^{5}-phosphanylidene)hexanoate Ethyl (4S)-4-(1,3-dioxoisoindolin-2-yl)-5-methyl-3-oxo-2-(triphenyl-$l^{5}-phosphanylidene)hexanoate
Wiley ID 785206