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(2S)-Methyl 4-methyl-2-[(4S,5S)-5'-carbonyl-4'-benzyloxazolidin-2'-one]aminopentanoate

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(2S)-Methyl 4-methyl-2-[(4S,5S)-5'-carbonyl-4'-benzyloxazolidin-2'-one]aminopentanoate
SpectraBase Compound ID 6UePQbByGhy
InChI InChI=1S/C18H24N2O5/c1-11(2)9-14(17(22)24-3)19-16(21)15-13(20-18(23)25-15)10-12-7-5-4-6-8-12/h4-8,11,13-15H,9-10H2,1-3H3,(H,19,21)(H,20,23)/t13-,14-,15-/m0/s1
InChIKey AQLFWCQDZFKRCV-KKUMJFAQSA-N
Mol Weight 348.4 g/mol
Molecular Formula C18H24N2O5
Exact Mass 348.168522 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GkqOIaLvrv3
Name (2S)-Methyl 4-methyl-2-[(4S,5S)-5'-carbonyl-4'-benzyloxazolidin-2'-one]aminopentanoate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 348.168521876 u
Formula C18H24N2O5
InChI InChI=1S/C18H24N2O5/c1-11(2)9-14(17(22)24-3)19-16(21)15-13(20-18(23)25-15)10-12-7-5-4-6-8-12/h4-8,11,13-15H,9-10H2,1-3H3,(H,19,21)(H,20,23)/t13-,14-,15-/m0/s1
InChIKey AQLFWCQDZFKRCV-KKUMJFAQSA-N
Molecular Weight 348.399 g/mol
SMILES [C@]1(C(N[C@](C(=O)OC)(CC(C)C)[H])=O)([C@@](NC(O1)=O)(CC1=CC=CC=C1)[H])[H]