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Cyclopentaneacetic acid, 4-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-2,3-dihydroxy-, ethyl ester, [1S-(1.alpha.,2.beta.,3.beta.,4.alpha.)]-
SpectraBase Compound ID BwsHIWeTKJx
InChI InChI=1S/C13H18N2O6/c1-2-21-10(17)6-7-5-8(12(19)11(7)18)15-4-3-9(16)14-13(15)20/h3-4,7-8,11-12,18-19H,2,5-6H2,1H3,(H,14,16,20)/t7-,8-,11-,12+/m1/s1
InChIKey XVHUTPBIPWBSSE-VNOQCFOKSA-N
Mol Weight 298.29 g/mol
Molecular Formula C13H18N2O6
Exact Mass 298.116486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JTScxRtkiI
Name Cyclopentaneacetic acid, 4-(3,4-dihydro-2,4-dioxo-1(2H)-pyrimidinyl)-2,3-dihydroxy-, ethyl ester, [1S-(1.alpha.,2.beta.,3.beta.,4.alpha.)]-
CAS Registry Number 119833-74-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18N2O6
InChI InChI=1S/C13H18N2O6/c1-2-21-10(17)6-7-5-8(12(19)11(7)18)15-4-3-9(16)14-13(15)20/h3-4,7-8,11-12,18-19H,2,5-6H2,1H3,(H,14,16,20)/t7-,8-,11-,12+/m1/s1
InChIKey XVHUTPBIPWBSSE-VNOQCFOKSA-N
Molecular Weight 298.295 g/mol
SMILES N1C(C=CN([C@]2([C@@]([C@@]([C@](C2)(CC(=O)OCC)[H])(O)[H])(O)[H])[H])C1=O)=O
SPLASH splash10-03xr-0900000000-389869d1d5004455c935
Source of Spectrum KC-1988-2929-11
Synonyms (1R,2R,3S,4R)-ethyl 4-(2,4-dioxo-3H-pyrimidin-1-yl)-2,3-dihydroxycyclopentane-1-acetate Ethyl[(1R,2R,3S,4R)-4-(2,4-dioxo-3,4-dihydro-1(2H)-pyrimidinyl)-2,3-dihydroxycyclopentyl]acetate
Wiley ID 1300591