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N-[.alpha.-(Ethoxycarbonyl)phenylethyl]-3,7,4,8-tetraphenyl-2,6-Imino-2H,6H-1,5-dithiocine
SpectraBase Compound ID HWFP0JsLw1W
InChI InChI=1S/C41H35NO2S2/c1-2-44-41(43)34(28-29-18-8-3-9-19-29)42-39-35(30-20-10-4-11-21-30)37(32-24-14-6-15-25-32)45-40(42)36(31-22-12-5-13-23-31)38(46-39)33-26-16-7-17-27-33/h3-27,34,39-40H,2,28H2,1H3/t34?,39-,40-/m1/s1
InChIKey LIPZYWFSYLFHPG-AEYQSHQWSA-N
Mol Weight 637.9 g/mol
Molecular Formula C41H35NO2S2
Exact Mass 637.210922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Od3ciGC4O
Name N-[.alpha.-(Ethoxycarbonyl)phenylethyl]-3,7,4,8-tetraphenyl-2,6-Imino-2H,6H-1,5-dithiocine
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Formula C41H35NO2S2
InChI InChI=1S/C41H35NO2S2/c1-2-44-41(43)34(28-29-18-8-3-9-19-29)42-39-35(30-20-10-4-11-21-30)37(32-24-14-6-15-25-32)45-40(42)36(31-22-12-5-13-23-31)38(46-39)33-26-16-7-17-27-33/h3-27,34,39-40H,2,28H2,1H3/t34?,39-,40-/m1/s1
InChIKey LIPZYWFSYLFHPG-AEYQSHQWSA-N
Molecular Weight 637.856 g/mol
SMILES [C@]12(N([C@](SC(=C2c2ccccc2)c2ccccc2)(C(=C(c2ccccc2)S1)c1ccccc1)[H])C(C(=O)OCC)Cc1ccccc1)[H]
SPLASH splash10-0fk9-0877409000-87faec255e7ec91a2907
Source of Spectrum SO-0-790-3
Wiley ID 876692