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(+-)-1-[(2'R*,3'S*)-2'-Phenylthio-3'-hydroxyhexyl]uracil
SpectraBase Compound ID BT2kuTu4WOn
InChI InChI=1S/C16H20N2O3S/c1-2-6-13(19)14(22-12-7-4-3-5-8-12)11-18-10-9-15(20)17-16(18)21/h3-5,7-10,13-14,19H,2,6,11H2,1H3,(H,17,20,21)/t13-,14+/m0/s1
InChIKey QAHGQYYXKBDRTA-UONOGXRCSA-N
Mol Weight 320.41 g/mol
Molecular Formula C16H20N2O3S
Exact Mass 320.119464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dz7h6OuNr30
Name (+-)-1-[(2'R*,3'S*)-2'-Phenylthio-3'-hydroxyhexyl]uracil
Alternate Name(s) (+-)-1-[(2'R,3'R)-2'-Phenylthio-3'-hydrohexyl]uracil (+-)-1-[(2'R*,3'S*)-2'-Phenylthio-3'-hydrohexyl]uracil 1-[(2R,3S)-3-hydroxy-2-(phenylsulfanyl)hexyl]-2,4(1H,3H)-pyrimidinedione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20N2O3S
InChI InChI=1S/C16H20N2O3S/c1-2-6-13(19)14(22-12-7-4-3-5-8-12)11-18-10-9-15(20)17-16(18)21/h3-5,7-10,13-14,19H,2,6,11H2,1H3,(H,17,20,21)/t13-,14+/m0/s1
InChIKey QAHGQYYXKBDRTA-UONOGXRCSA-N
Molecular Weight 320.407 g/mol
SMILES N1C(C=CN(C[C@]([C@@](O)(CCC)[H])(Sc2ccccc2)[H])C1=O)=O
SPLASH splash10-000i-0910000000-90b9316746faaf74b200
Source of Spectrum F-52-3622-5
Wiley ID 795697