For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-6-methoxy-5-(phenylcarbonyl)-6-(trifluoromethyl)-1H-pyrimidin-2-one
SpectraBase Compound ID JcNDZhQUqhf
InChI InChI=1S/C18H19F3N2O7/c1-29-17(18(19,20)21)10(12(25)9-5-3-2-4-6-9)7-23(16(28)22-17)15-14(27)13(26)11(8-24)30-15/h2-7,11,13-15,24,26-27H,8H2,1H3,(H,22,28)/t11-,13-,14-,15-,17?/m1/s1
InChIKey QHNIHXCPUOTYSM-WMSQIARESA-N
Mol Weight 432.35 g/mol
Molecular Formula C18H19F3N2O7
Exact Mass 432.114435 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8UYg41nOT02
Name 3-[(2R,3R,4S,5R)-5-(hydroxymethyl)-3,4-bis(oxidanyl)oxolan-2-yl]-6-methoxy-5-(phenylcarbonyl)-6-(trifluoromethyl)-1H-pyrimidin-2-one
Alternate Name(s) 5-Benzoyl-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)-2-oxolanyl]-6-methoxy-6-(trifluoromethyl)-1H-pyrimidin-2-one 5-Benzoyl-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]-6-methoxy-6-(trifluoromethyl)-1H-pyrimidin-2-one 5-Benzoyl-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl]-6-methoxy-6-(trifluoromethyl)-1H-pyrimidin-2-one 5-Benzoyl-3-[(2R,3R,4S,5R)-3,4-dihydroxy-5-methylol-tetrahydrofuran-2-yl]-6-methoxy-6-(trifluoromethyl)-1H-pyrimidin-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H19F3N2O7
InChI InChI=1S/C18H19F3N2O7/c1-29-17(18(19,20)21)10(12(25)9-5-3-2-4-6-9)7-23(16(28)22-17)15-14(27)13(26)11(8-24)30-15/h2-7,11,13-15,24,26-27H,8H2,1H3,(H,22,28)/t11-,13-,14-,15-,17?/m1/s1
InChIKey QHNIHXCPUOTYSM-WMSQIARESA-N
Molecular Weight 432.352 g/mol
SMILES O[C@@]1([C@](O[C@]([C@@]1(O)[H])(N1C(NC(C(=C1)C(=O)c1ccccc1)(C(F)(F)F)OC)=O)[H])(CO)[H])[H]
SPLASH splash10-014i-0390100000-cbee9fd3febcdbc08238
Source of Spectrum KC-57-7374-10
Wiley ID 1625442