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(4aR,7R,8aS)-1-(2-phenyl-hexahydropyrano[3,2-d][1,3]dioxin-7-yl)-1H-pyrimidine-2,4-dione
SpectraBase Compound ID DIs9vPPgCWd
InChI InChI=1S/C17H18N2O5/c20-15-6-7-19(17(21)18-15)12-8-13-14(22-9-12)10-23-16(24-13)11-4-2-1-3-5-11/h1-7,12-14,16H,8-10H2,(H,18,20,21)/t12-,13+,14-,16?/m1/s1
InChIKey NQHVAFONVMTDJA-MHRDGSLOSA-N
Mol Weight 330.34 g/mol
Molecular Formula C17H18N2O5
Exact Mass 330.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVCb1UG1iQw
Name (4aR,7R,8aS)-1-(2-phenyl-hexahydropyrano[3,2-d][1,3]dioxin-7-yl)-1H-pyrimidine-2,4-dione
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H18N2O5
InChI InChI=1S/C17H18N2O5/c20-15-6-7-19(17(21)18-15)12-8-13-14(22-9-12)10-23-16(24-13)11-4-2-1-3-5-11/h1-7,12-14,16H,8-10H2,(H,18,20,21)/t12-,13+,14-,16?/m1/s1
InChIKey NQHVAFONVMTDJA-MHRDGSLOSA-N
Ionization Type EI
Molecular Weight 330.340 g/mol
SMILES N1C(N(C=CC1=O)[C@]1(CO[C@@]2(COC(O[C@]2(C1)[H])c1ccccc1)[H])[H])=O
SPLASH splash10-03di-0900000000-be903fcf375c742470ea
Source of Spectrum US20110070192A1
Thin-Layer Chromatography Rf = 0.28 (70% EtOAc-hexane)
Wiley ID 1861725