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(2S,5S,6R)-1-benzoyl-2-tert-butyl-5-[(1R)-1-hydroxyethyl]-3,6-dimethyl-1,3-diazinan-4-one

View entire compound with spectra: 1 MS (GC)

(2S,5S,6R)-1-benzoyl-2-tert-butyl-5-[(1R)-1-hydroxyethyl]-3,6-dimethyl-1,3-diazinan-4-one
SpectraBase Compound ID 45vYSpCaJ5M
InChI InChI=1S/C19H28N2O3/c1-12-15(13(2)22)17(24)20(6)18(19(3,4)5)21(12)16(23)14-10-8-7-9-11-14/h7-13,15,18,22H,1-6H3/t12-,13-,15+,18+/m1/s1
InChIKey OWLPKLBAGXEDET-ONUSSAAZSA-N
Mol Weight 332.44 g/mol
Molecular Formula C19H28N2O3
Exact Mass 332.209993 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LrFoninJx7N
Name (2S,5S,6R)-1-benzoyl-2-tert-butyl-5-[(1R)-1-hydroxyethyl]-3,6-dimethyl-1,3-diazinan-4-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28N2O3
InChI InChI=1S/C19H28N2O3/c1-12-15(13(2)22)17(24)20(6)18(19(3,4)5)21(12)16(23)14-10-8-7-9-11-14/h7-13,15,18,22H,1-6H3/t12-,13-,15+,18+/m1/s1
InChIKey OWLPKLBAGXEDET-ONUSSAAZSA-N
Molecular Weight 332.444 g/mol
SMILES O[C@@]([C@]1(C(=O)N([C@@](N([C@@]1(C)[H])C(=O)c1ccccc1)(C(C)(C)C)[H])C)[H])(C)[H]
SPLASH splash10-0a4i-2930000000-e61227c0a526cb0b5bc8
Source of Spectrum H1-39-339-19
Synonyms (2S,5S,6R)-1-benzoyl-2-tert-butyl-5-[(1R)-1-hydroxyethyl]-3,6-dimethyl-hexahydropyrimidin-4-one (2S,5S,6R)-2-tert-butyl-3,6-dimethyl-5-[(1R)-1-oxidanylethyl]-1-(phenylcarbonyl)-1,3-diazinan-4-one
Wiley ID 756788