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1-[(2R,3S)-2-(dibenzylamino)-3-hydroxy-hexyl]pyrimidine-2,4-dione
SpectraBase Compound ID 32ylLUzfJXS
InChI InChI=1S/C24H29N3O3/c1-2-9-22(28)21(18-26-15-14-23(29)25-24(26)30)27(16-19-10-5-3-6-11-19)17-20-12-7-4-8-13-20/h3-8,10-15,21-22,28H,2,9,16-18H2,1H3,(H,25,29,30)/t21-,22+/m1/s1
InChIKey LRUWSFIFEAOUEN-YADHBBJMSA-N
Mol Weight 407.51 g/mol
Molecular Formula C24H29N3O3
Exact Mass 407.220892 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AK6yMTcDgsZ
Name 1-[(2R,3S)-2-(dibenzylamino)-3-hydroxy-hexyl]pyrimidine-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H29N3O3
InChI InChI=1S/C24H29N3O3/c1-2-9-22(28)21(18-26-15-14-23(29)25-24(26)30)27(16-19-10-5-3-6-11-19)17-20-12-7-4-8-13-20/h3-8,10-15,21-22,28H,2,9,16-18H2,1H3,(H,25,29,30)/t21-,22+/m1/s1
InChIKey LRUWSFIFEAOUEN-YADHBBJMSA-N
Molecular Weight 407.514 g/mol
SMILES N1C(C=CN(C[C@]([C@@](O)(CCC)[H])(N(Cc2ccccc2)Cc2ccccc2)[H])C1=O)=O
SPLASH splash10-001i-3379000000-5b5b44b98c72b732d092
Source of Spectrum KC-0-519-11
Synonyms 1-[(2R,3S)-2-(dibenzylamino)-3-hydroxy-hexyl]pyrimidine-2,4-quinone 1-[(2R,3S)-2-[bis(phenylmethyl)amino]-3-hydroxyhexyl]pyrimidine-2,4-dione 1-[(2R,3S)-2-[bis(phenylmethyl)amino]-3-oxidanyl-hexyl]pyrimidine-2,4-dione
Wiley ID 787542