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(3S,4S)-4-[(E)-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]iminomethyl]-3-methylhexanoic acid methyl ester
SpectraBase Compound ID LTlkIpkPrCB
InChI InChI=1S/C15H28N2O3/c1-5-13(12(2)9-15(18)20-4)10-16-17-8-6-7-14(17)11-19-3/h10,12-14H,5-9,11H2,1-4H3/b16-10+/t12-,13+,14-/m0/s1
InChIKey JSWCYJYHHSPWME-PGNZMLNNSA-N
Mol Weight 284.4 g/mol
Molecular Formula C15H28N2O3
Exact Mass 284.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A7eRXahTMxQ
Name (3S,4S)-4-[(E)-[(2S)-2-(methoxymethyl)-1-pyrrolidinyl]iminomethyl]-3-methylhexanoic acid methyl ester
Alternate Name(s) (3S,4S)-4-[(E)-[(2S)-2-(methoxymethyl)pyrrolidino]iminomethyl]-3-methyl-hexanoic acid methyl ester Methyl (3S,4S)-4-[(E)-[(2S)-2-(methoxymethyl)pyrrolidin-1-yl]iminomethyl]-3-methyl-hexanoate
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Formula C15H28N2O3
InChI InChI=1S/C15H28N2O3/c1-5-13(12(2)9-15(18)20-4)10-16-17-8-6-7-14(17)11-19-3/h10,12-14H,5-9,11H2,1-4H3/b16-10+/t12-,13+,14-/m0/s1
InChIKey JSWCYJYHHSPWME-PGNZMLNNSA-N
Molecular Weight 284.400 g/mol
SMILES [C@](\C=N\N1[C@](COC)(CCC1)[H])([C@](CC(=O)OC)(C)[H])(CC)[H]
SPLASH splash10-000i-5190000000-0bbf14eb237a78921a86
Source of Spectrum U-1997-1120-5
Wiley ID 769667