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(S,S,R)-tert-Butyl 2-[.alpha.-N-(2-methoxymethylpyrrolidin-1-yl)aminobenzyl]pent-3-enoate
SpectraBase Compound ID FNNJHvfp9n6
InChI InChI=1S/C22H34N2O3/c1-6-11-19(21(25)27-22(2,3)4)20(17-12-8-7-9-13-17)23-24-15-10-14-18(24)16-26-5/h6-9,11-13,18-20,23H,10,14-16H2,1-5H3/b11-6+/t18-,19-,20-/m0/s1
InChIKey LJWYQMABHROPAJ-AMQDWLPNSA-N
Mol Weight 374.5 g/mol
Molecular Formula C22H34N2O3
Exact Mass 374.256943 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FoSfo5mVvGl
Name (S,S,R)-tert-Butyl 2-[.alpha.-N-(2-methoxymethylpyrrolidin-1-yl)aminobenzyl]pent-3-enoate
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Formula C22H34N2O3
InChI InChI=1S/C22H34N2O3/c1-6-11-19(21(25)27-22(2,3)4)20(17-12-8-7-9-13-17)23-24-15-10-14-18(24)16-26-5/h6-9,11-13,18-20,23H,10,14-16H2,1-5H3/b11-6+/t18-,19-,20-/m0/s1
InChIKey LJWYQMABHROPAJ-AMQDWLPNSA-N
Molecular Weight 374.525 g/mol
SMILES N([C@]([C@@](C(OC(C)(C)C)=O)(\C=C\C)[H])(c1ccccc1)[H])N1[C@](COC)(CCC1)[H]
SPLASH splash10-00b9-1913000000-36b52076861795e7fcf9
Source of Spectrum SO-0-1324-3
Synonyms tert-Butyl (2S,3E)-2-[(R)-{[(2S)-2-(methoxymethyl)pyrrolidinyl]amino}(phenyl)methyl]-3-pentenoate
Wiley ID 1545352