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E-(+)-(2S,1"R,2"S)-1-{ 2'-[2"-Methoxycarbonyl)cyclohexyl ]-1'-(2"-naphthyl)ethylideneamino-2-(methoxymethyl) pyrrolidine
SpectraBase Compound ID 5zthRUHmaij
InChI InChI=1S/C26H34N2O3/c1-30-18-23-11-7-15-28(23)27-25(17-21-10-5-6-12-24(21)26(29)31-2)22-14-13-19-8-3-4-9-20(19)16-22/h3-4,8-9,13-14,16,21,23-24H,5-7,10-12,15,17-18H2,1-2H3/b27-25+/t21-,23-,24+/m0/s1
InChIKey LWXMHRYSPKVQSC-TYGLOPRFSA-N
Mol Weight 422.6 g/mol
Molecular Formula C26H34N2O3
Exact Mass 422.256943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8kbgGnoY4SL
Name E-(+)-(2S,1"R,2"S)-1-{ 2'-[2"-Methoxycarbonyl)cyclohexyl ]-1'-(2"-naphthyl)ethylideneamino-2-(methoxymethyl) pyrrolidine
Alternate Name(s) Methyl (1R,2S)-2-[(2E)-2-{[(2S)-2-(methoxymethyl)pyrrolidinyl]imino}-2-(2-naphthyl)ethyl]cyclohexanecarboxylate
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Formula C26H34N2O3
InChI InChI=1S/C26H34N2O3/c1-30-18-23-11-7-15-28(23)27-25(17-21-10-5-6-12-24(21)26(29)31-2)22-14-13-19-8-3-4-9-20(19)16-22/h3-4,8-9,13-14,16,21,23-24H,5-7,10-12,15,17-18H2,1-2H3/b27-25+/t21-,23-,24+/m0/s1
InChIKey LWXMHRYSPKVQSC-TYGLOPRFSA-N
Molecular Weight 422.569 g/mol
SMILES [C@]1(N(\N=C\(c2cc3ccccc3cc2)C[C@]2([C@](C(=O)OC)(CCCC2)[H])[H])CCC1)(COC)[H]
SPLASH splash10-004i-2209100000-35bbcaf497cdfbb0f558
Source of Spectrum K-126-1938-9
Wiley ID 1378749