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Benzyl rac-(2R,5S,6S)-2-(t-butyl)-5-[(t-butoxycarbonyl)methyl]-6-methyl-4-methoxy-5,6-dihydro-2H-pyrimidine-1-carboxylate
SpectraBase Compound ID KWESpGV1mcC
InChI InChI=1S/C24H36N2O5/c1-16-18(14-19(27)31-24(5,6)7)20(29-8)25-21(23(2,3)4)26(16)22(28)30-15-17-12-10-9-11-13-17/h9-13,16,18,21H,14-15H2,1-8H3/t16-,18-,21+/m0/s1
InChIKey ZDSBAMUXEFKZLO-DJPFJPOOSA-N
Mol Weight 432.6 g/mol
Molecular Formula C24H36N2O5
Exact Mass 432.262422 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3DYjUOZaVYx
Name Benzyl rac-(2R,5S,6S)-2-(t-butyl)-5-[(t-butoxycarbonyl)methyl]-6-methyl-4-methoxy-5,6-dihydro-2H-pyrimidine-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H36N2O5
InChI InChI=1S/C24H36N2O5/c1-16-18(14-19(27)31-24(5,6)7)20(29-8)25-21(23(2,3)4)26(16)22(28)30-15-17-12-10-9-11-13-17/h9-13,16,18,21H,14-15H2,1-8H3/t16-,18-,21+/m0/s1
InChIKey ZDSBAMUXEFKZLO-DJPFJPOOSA-N
Molecular Weight 432.561 g/mol
SMILES [C@]1(N([C@]([C@@](C(=N1)OC)(CC(OC(C)(C)C)=O)[H])(C)[H])C(OCc1ccccc1)=O)(C(C)(C)C)[H]
SPLASH splash10-004i-0069000000-acad0c97d49d89213796
Source of Spectrum U1-1999-349-0
Synonyms benzyl (2R,5S,6S)-5-(2-tert-butoxy-2-oxoethyl)-2-tert-butyl-4-methoxy-6-methyl-5,6-dihydro-1(2H)-pyrimidinecarboxylate (2R,4S,5S)-2-tert-butyl-6-methoxy-4-methyl-5-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-4,5-dihydro-2H-pyrimidine-3-carboxylic acid (phenylmethyl) ester benzyl (2R,4S,5S)-2-tert-butyl-6-methoxy-4-methyl-5-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-4,5-dihydro-2H-pyrimidine-3-carboxylate benzyl (2R,4S,5S)-5-(2-tert-butoxy-2-oxo-ethyl)-2-tert-butyl-6-methoxy-4-methyl-4,5-dihydro-2H-pyrimidine-3-carboxylate (phenylmethyl) (2R,4S,5S)-2-tert-butyl-6-methoxy-4-methyl-5-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]-4,5-dihydro-2H-pyrimidine-3-carboxylate
Wiley ID 752535