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N-[(1S)-2-Acetoxy-1-methoxymethylethyl](4E,7S)-7-methoxy-4-eicosenamide
SpectraBase Compound ID JvygwDxZrYx
InChI InChI=1S/C27H51NO5/c1-5-6-7-8-9-10-11-12-13-14-16-19-26(32-4)20-17-15-18-21-27(30)28-25(22-31-3)23-33-24(2)29/h15,17,25-26H,5-14,16,18-23H2,1-4H3,(H,28,30)/b17-15+/t25-,26-/m0/s1
InChIKey WFKUSCKQTNNIKL-UMJAWYJHSA-N
Mol Weight 469.7 g/mol
Molecular Formula C27H51NO5
Exact Mass 469.376724 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2isoBw8sjIm
Name N-[(1S)-2-Acetoxy-1-methoxymethylethyl](4E,7S)-7-methoxy-4-eicosenamide
Alternate Name(s) (2S)-3-methoxy-2-{[(4E,7S)-7-methoxy-4-icosenoyl]amino}propyl acetate Acetic acid[(2S)-3-methoxy-2-[[(E,7S)-7-methoxy-1-oxoeicos-4-enyl]amino]propyl]ester Acetic acid[(2S)-3-methoxy-2-[[(E,7S)-7-methoxyeicos-4-enoyl]amino]propyl]ester [(2S)-3-methoxy-2-[[(E,7S)-7-methoxyicos-4-enoyl]amino]propyl]acetate [(2S)-3-methoxy-2-[[(E,7S)-7-methoxyicos-4-enoyl]amino]propyl]ethanoate Acetic acid [(2S)-3-methoxy-2-[[(E,7S)-7-methoxy-1-oxoeicos-4-enyl]amino]propyl] ester [(2S)-3-methoxy-2-[[(E,7S)-7-methoxyicos-4-enoyl]amino]propyl] acetate [(2S)-3-methoxy-2-[[(E,7S)-7-methoxyicos-4-enoyl]amino]propyl] ethanoate
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Formula C27H51NO5
InChI InChI=1S/C27H51NO5/c1-5-6-7-8-9-10-11-12-13-14-16-19-26(32-4)20-17-15-18-21-27(30)28-25(22-31-3)23-33-24(2)29/h15,17,25-26H,5-14,16,18-23H2,1-4H3,(H,28,30)/b17-15+/t25-,26-/m0/s1
InChIKey WFKUSCKQTNNIKL-UMJAWYJHSA-N
Molecular Weight 469.707 g/mol
SMILES N(C(=O)CC\C=C\C[C@@](OC)(CCCCCCCCCCCCC)[H])[C@](COC(=O)C)(COC)[H]
SPLASH splash10-000l-0970000000-c464027e11d37e3bc068
Source of Spectrum QC-17-937-1
Wiley ID 1638147