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(E)-2-Decyl-2-ethoxycarbonyl-1-(4-methoxyphenyl)-3-phenylaziridine
SpectraBase Compound ID KMKdqyu7OYt
InChI InChI=1S/C28H39NO3/c1-4-6-7-8-9-10-11-15-22-28(27(30)32-5-2)26(23-16-13-12-14-17-23)29(28)24-18-20-25(31-3)21-19-24/h12-14,16-21,26H,4-11,15,22H2,1-3H3/t26-,28+,29?/m1/s1
InChIKey RXCRRFZQEDWRNH-XVQBCLTESA-N
Mol Weight 437.6 g/mol
Molecular Formula C28H39NO3
Exact Mass 437.292994 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H952hnnVfY0
Name (E)-2-Decyl-2-ethoxycarbonyl-1-(4-methoxyphenyl)-3-phenylaziridine
Alternate Name(s) (2S,3R)-2-Decyl-1-(4-methoxy-phenyl)-3-phenyl-aziridine-2-carboxylic acid ethyl ester Ethyl 2-decyl-1-(4-methoxyphenyl)-3-phenyl-2-aziridinecarboxylate
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Formula C28H39NO3
InChI InChI=1S/C28H39NO3/c1-4-6-7-8-9-10-11-15-22-28(27(30)32-5-2)26(23-16-13-12-14-17-23)29(28)24-18-20-25(31-3)21-19-24/h12-14,16-21,26H,4-11,15,22H2,1-3H3/t26-,28+,29?/m1/s1
InChIKey RXCRRFZQEDWRNH-XVQBCLTESA-N
Molecular Weight 437.624 g/mol
SMILES [C@]1(N(c2ccc(OC)cc2)[C@@]1(c1ccccc1)[H])(C(=O)OCC)CCCCCCCCCC
SPLASH splash10-00bi-0092600000-5acb4c18d8f06a4a81c1
Source of Spectrum F-56-4424-25
Wiley ID 857470