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(1R,2R,3R,4R) 1-[2,3-(Isopropylidenedioxy)-4-(prop-2-yn-1-yloxymethyl)tetrahydrofuran-2-yl]-3-benzyl-1,2,3,4-tetrahydropyrimidin-2,4-dione
SpectraBase Compound ID 99KYEIgr3k8
InChI InChI=1S/C22H24N2O6/c1-4-12-27-14-16-18-19(30-22(2,3)29-18)20(28-16)23-11-10-17(25)24(21(23)26)13-15-8-6-5-7-9-15/h1,5-11,16,18-20H,12-14H2,2-3H3/t16-,18-,19-,20-/m1/s1
InChIKey KDLBAOVKFGKZLJ-VBSBHUPXSA-N
Mol Weight 412.44 g/mol
Molecular Formula C22H24N2O6
Exact Mass 412.163436 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3fRdKoMEd3t
Name (1R,2R,3R,4R) 1-[2,3-(Isopropylidenedioxy)-4-(prop-2-yn-1-yloxymethyl)tetrahydrofuran-2-yl]-3-benzyl-1,2,3,4-tetrahydropyrimidin-2,4-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H24N2O6
InChI InChI=1S/C22H24N2O6/c1-4-12-27-14-16-18-19(30-22(2,3)29-18)20(28-16)23-11-10-17(25)24(21(23)26)13-15-8-6-5-7-9-15/h1,5-11,16,18-20H,12-14H2,2-3H3/t16-,18-,19-,20-/m1/s1
InChIKey KDLBAOVKFGKZLJ-VBSBHUPXSA-N
Molecular Weight 412.442 g/mol
SMILES C1(N(C=CC(N1Cc1ccccc1)=O)[C@]1([C@]2([C@](OC(O2)(C)C)([C@](O1)(COCC#C)[H])[H])[H])[H])=O
SPLASH splash10-0006-9010000000-ee77aad503d07c3f9896
Source of Spectrum F-56-7557-2
Synonyms 1-[(3aR,4R,6R,6aR)-2,2-dimethyl-6-[(prop-2-yn-1-yloxy)methyl]-tetrahydro-2H-furo[3,4-d][1,3]dioxol-4-yl]-3-benzyl-1,2,3,4-tetrahydropyrimidine-2,4-dione 1-[2,3-(Isopropylidenedioxy)-4-(prop-2-yn-1-yloxymethyl)tetrahydrofuran-2-yl]-3-benzyl-1,2,3,4-tetrahydropyrimidin-2,4-dione 3-Benzyl-1-((3aR,4R,6R,6aR)-2,2-dimethyl-6-prop-2-ynyloxymethyl-tetrahydro-furo[3,4-d][1,3]dioxol-4-yl)-1H-pyrimidine-2,4-dione
Wiley ID 858689