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Methyl 3-[12'-ethenyl- 9',10'-dihydro-9',10'-ethanoanthracene-11'-yl)-3-oxo-2-(triphenylphosphoranyidene)propanoate
SpectraBase Compound ID 9HHf1sUhjZF
InChI InChI=1S/C40H33O3P/c1-3-30-35-31-23-13-15-25-33(31)36(34-26-16-14-24-32(34)35)37(30)38(41)39(40(42)43-2)44(27-17-7-4-8-18-27,28-19-9-5-10-20-28)29-21-11-6-12-22-29/h3-26,30,35-37H,1H2,2H3/t30?,35-,36?,37-/m0/s1
InChIKey YVONDNCUVBANJA-OZLPACJUSA-N
Mol Weight 592.7 g/mol
Molecular Formula C40H33O3P
Exact Mass 592.216732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cj66AKs4wFh
Name Methyl 3-[12'-ethenyl- 9',10'-dihydro-9',10'-ethanoanthracene-11'-yl)-3-oxo-2-(triphenylphosphoranyidene)propanoate
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Formula C40H33O3P
InChI InChI=1S/C40H33O3P/c1-3-30-35-31-23-13-15-25-33(31)36(34-26-16-14-24-32(34)35)37(30)38(41)39(40(42)43-2)44(27-17-7-4-8-18-27,28-19-9-5-10-20-28)29-21-11-6-12-22-29/h3-26,30,35-37H,1H2,2H3/t30?,35-,36?,37-/m0/s1
InChIKey YVONDNCUVBANJA-OZLPACJUSA-N
Molecular Weight 592.675 g/mol
SMILES C(C([C@@]1(C2c3ccccc3C(C1C=C)c1ccccc21)[H])=O)(=P(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)OC
SPLASH splash10-01t9-0931000000-e64f7979d40b6283eb7b
Source of Spectrum B-52-670-24
Synonyms Methyl 3-(12'-ethenyl-9',10'-dihydro-9',10'-ethanoanthracene-11'-ylidene)-3-oxo-2-(triphenylphosphoranylidene)propanoate
Wiley ID 746320