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Benzyl rac-(2R,5S,6S)-2-(t-butyl)-5-allyl-6-methyl-4-methoxy-5,6-dihydro-2H-pyrimidine-1-carboxylate
SpectraBase Compound ID 1BDgRrKi6pe
InChI InChI=1S/C21H30N2O3/c1-7-11-17-15(2)23(19(21(3,4)5)22-18(17)25-6)20(24)26-14-16-12-9-8-10-13-16/h7-10,12-13,15,17,19H,1,11,14H2,2-6H3/t15-,17-,19+/m0/s1
InChIKey FYBXDYNSRMOXNP-VDZJLULYSA-N
Mol Weight 358.48 g/mol
Molecular Formula C21H30N2O3
Exact Mass 358.225643 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2i25HSXBHCM
Name Benzyl rac-(2R,5S,6S)-2-(t-butyl)-5-allyl-6-methyl-4-methoxy-5,6-dihydro-2H-pyrimidine-1-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H30N2O3
InChI InChI=1S/C21H30N2O3/c1-7-11-17-15(2)23(19(21(3,4)5)22-18(17)25-6)20(24)26-14-16-12-9-8-10-13-16/h7-10,12-13,15,17,19H,1,11,14H2,2-6H3/t15-,17-,19+/m0/s1
InChIKey FYBXDYNSRMOXNP-VDZJLULYSA-N
Molecular Weight 358.482 g/mol
SMILES [C@]1(N([C@]([C@@](C(=N1)OC)(CC=C)[H])(C)[H])C(OCc1ccccc1)=O)(C(C)(C)C)[H]
SPLASH splash10-0k96-9088000000-547f7dff6f555e2723aa
Source of Spectrum U1-1999-349-0
Synonyms benzyl (2R,5S,6S)-5-allyl-2-tert-butyl-4-methoxy-6-methyl-5,6-dihydro-1(2H)-pyrimidinecarboxylate (2R,4S,5S)-2-tert-butyl-6-methoxy-4-methyl-5-prop-2-enyl-4,5-dihydro-2H-pyrimidine-3-carboxylic acid (phenylmethyl) ester benzyl (2R,4S,5S)-2-tert-butyl-6-methoxy-4-methyl-5-prop-2-enyl-4,5-dihydro-2H-pyrimidine-3-carboxylate benzyl (2R,4S,5S)-5-allyl-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-prop-2-enyl-4,5-dihydro-2H-pyrimidine-3-carboxylate
Wiley ID 752534