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1-[(2R,3S)-2-(diallylamino)-3-hydroxy-hexyl]pyrimidine-2,4-dione
SpectraBase Compound ID IXEaTfejQvz
InChI InChI=1S/C16H25N3O3/c1-4-7-14(20)13(18(9-5-2)10-6-3)12-19-11-8-15(21)17-16(19)22/h5-6,8,11,13-14,20H,2-4,7,9-10,12H2,1H3,(H,17,21,22)/t13-,14+/m1/s1
InChIKey LAEZIGMWVCDIHI-KGLIPLIRSA-N
Mol Weight 307.39 g/mol
Molecular Formula C16H25N3O3
Exact Mass 307.189592 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3nUibwUHuS
Name 1-[(2R,3S)-2-(diallylamino)-3-hydroxy-hexyl]pyrimidine-2,4-dione
Alternate Name(s) 1-[(2R,3S)-2-(diallylamino)-3-hydroxy-hexyl]pyrimidine-2,4-quinone 1-[(2R,3S)-2-[bis(prop-2-enyl)amino]-3-hydroxyhexyl]pyrimidine-2,4-dione 1-[(2R,3S)-2-[bis(prop-2-enyl)amino]-3-oxidanyl-hexyl]pyrimidine-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H25N3O3
InChI InChI=1S/C16H25N3O3/c1-4-7-14(20)13(18(9-5-2)10-6-3)12-19-11-8-15(21)17-16(19)22/h5-6,8,11,13-14,20H,2-4,7,9-10,12H2,1H3,(H,17,21,22)/t13-,14+/m1/s1
InChIKey LAEZIGMWVCDIHI-KGLIPLIRSA-N
Molecular Weight 307.394 g/mol
SMILES N1C(C=CN(C[C@]([C@@](O)(CCC)[H])(N(CC=C)CC=C)[H])C1=O)=O
SPLASH splash10-001l-7940000000-8d055c753ebc2af768f6
Source of Spectrum KC-0-519-11
Wiley ID 787541