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N-[2'-(Phenylthio)-2'-phenylethyl]-N-(ethoxycarbonyl)-3,4-dimethoxyphenyl-ethylamine
SpectraBase Compound ID Hh8NfR4hgVG
InChI InChI=1S/C27H31NO4S/c1-4-32-27(29)28(18-17-21-15-16-24(30-2)25(19-21)31-3)20-26(22-11-7-5-8-12-22)33-23-13-9-6-10-14-23/h5-16,19,26H,4,17-18,20H2,1-3H3
InChIKey UWNCTFBMUKIVAF-UHFFFAOYSA-N
Mol Weight 465.61 g/mol
Molecular Formula C27H31NO4S
Exact Mass 465.19738 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXcdc1OOhRe
Name N-[2'-(Phenylthio)-2'-phenylethyl]-N-(ethoxycarbonyl)-3,4-dimethoxyphenyl-ethylamine
Alternate Name(s) [2-(3,4-Dimethoxy-phenyl)-ethyl]-(2-phenyl-2-phenylsulfanyl-ethyl)-carbamic acid ethyl ester
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Formula C27H31NO4S
InChI InChI=1S/C27H31NO4S/c1-4-32-27(29)28(18-17-21-15-16-24(30-2)25(19-21)31-3)20-26(22-11-7-5-8-12-22)33-23-13-9-6-10-14-23/h5-16,19,26H,4,17-18,20H2,1-3H3
InChIKey UWNCTFBMUKIVAF-UHFFFAOYSA-N
Molecular Weight 465.608 g/mol
SMILES C(N(CC(Sc1ccccc1)c1ccccc1)CCc1cc(OC)c(cc1)OC)(=O)OCC
SPLASH splash10-0j4i-0941000000-ac51ec9cc612d6afd4ef
Source of Spectrum SK-23-2494-6b
Wiley ID 865719