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(+)-(2S,3R)-3-(N,N-Diallylamino)-4-morpholino-1-tridecyloxybutan-2-ol
SpectraBase Compound ID BKjb75eHTgK
InChI InChI=1S/C27H52N2O3/c1-4-7-8-9-10-11-12-13-14-15-16-21-32-25-27(30)26(29(17-5-2)18-6-3)24-28-19-22-31-23-20-28/h5-6,26-27,30H,2-4,7-25H2,1H3/t26-,27-/m1/s1
InChIKey BZMCJMAPWUXKLQ-KAYWLYCHSA-N
Mol Weight 452.7 g/mol
Molecular Formula C27H52N2O3
Exact Mass 452.397794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Jml8fepxe5
Name (+)-(2S,3R)-3-(N,N-Diallylamino)-4-morpholino-1-tridecyloxybutan-2-ol
Alternate Name(s) (2S,3R)-3-(diallylamino)-4-(4-morpholinyl)-1-(tridecyloxy)-2-butanol (2S,3R)-3-[bis(prop-2-enyl)amino]-4-(4-morpholinyl)-1-tridecoxy-2-butanol (2S,3R)-3-[bis(prop-2-enyl)amino]-4-morpholin-4-yl-1-tridecoxybutan-2-ol (2S,3R)-3-[bis(prop-2-enyl)amino]-4-morpholin-4-yl-1-tridecoxy-butan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H52N2O3
InChI InChI=1S/C27H52N2O3/c1-4-7-8-9-10-11-12-13-14-15-16-21-32-25-27(30)26(29(17-5-2)18-6-3)24-28-19-22-31-23-20-28/h5-6,26-27,30H,2-4,7-25H2,1H3/t26-,27-/m1/s1
InChIKey BZMCJMAPWUXKLQ-KAYWLYCHSA-N
Molecular Weight 452.724 g/mol
SMILES O[C@@]([C@@](CN1CCOCC1)(N(CC=C)CC=C)[H])(COCCCCCCCCCCCCC)[H]
SPLASH splash10-0w29-1306900000-0a34433fa2499477b329
Source of Spectrum KC-0-523-29
Wiley ID 787521