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(2S)-2-[[(2R,3S)-2-(diallylamino)-3-hydroxy-hexyl]amino]propionic acid methyl ester
SpectraBase Compound ID 6MjqoOQ0NqP
InChI InChI=1S/C16H30N2O3/c1-6-9-15(19)14(18(10-7-2)11-8-3)12-17-13(4)16(20)21-5/h7-8,13-15,17,19H,2-3,6,9-12H2,1,4-5H3/t13-,14+,15-/m0/s1
InChIKey CUFHQJYLWNBGLK-ZNMIVQPWSA-N
Mol Weight 298.43 g/mol
Molecular Formula C16H30N2O3
Exact Mass 298.225643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID PDTot3zLhY
Name (2S)-2-[[(2R,3S)-2-(diallylamino)-3-hydroxy-hexyl]amino]propionic acid methyl ester
Alternate Name(s) (2S)-2-[[(2R,3S)-2-[bis(prop-2-enyl)amino]-3-hydroxyhexyl]amino]propanoic acid methyl ester Methyl (2S)-2-[[(2R,3S)-2-(diallylamino)-3-hydroxy-hexyl]amino]propanoate Methyl (2S)-2-[[(2R,3S)-2-[bis(prop-2-enyl)amino]-3-hydroxyhexyl]amino]propanoate Methyl (2S)-2-[[(2R,3S)-2-[bis(prop-2-enyl)amino]-3-oxidanyl-hexyl]amino]propanoate
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Formula C16H30N2O3
InChI InChI=1S/C16H30N2O3/c1-6-9-15(19)14(18(10-7-2)11-8-3)12-17-13(4)16(20)21-5/h7-8,13-15,17,19H,2-3,6,9-12H2,1,4-5H3/t13-,14+,15-/m0/s1
InChIKey CUFHQJYLWNBGLK-ZNMIVQPWSA-N
Molecular Weight 298.427 g/mol
SMILES N(C[C@]([C@@](O)(CCC)[H])(N(CC=C)CC=C)[H])[C@](C(=O)OC)(C)[H]
SPLASH splash10-001l-5920000000-10049399539cd2b8fb31
Source of Spectrum F-54-15734-14
Wiley ID 804335