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(2S,5S,6R)-2-isopropyl-4,5-dimethyl-6-phenyl-morpholin-3-one

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

(2S,5S,6R)-2-isopropyl-4,5-dimethyl-6-phenyl-morpholin-3-one
SpectraBase Compound ID LO2qr8YYf5J
InChI InChI=1S/C15H21NO2/c1-10(2)13-15(17)16(4)11(3)14(18-13)12-8-6-5-7-9-12/h5-11,13-14H,1-4H3/t11-,13-,14-/m0/s1
InChIKey PKQDDMVFNLNWQG-UBHSHLNASA-N
Mol Weight 247.34 g/mol
Molecular Formula C15H21NO2
Exact Mass 247.157229 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7qpfflIZu5M
Name (2S,5S,6R)-2-Isopropyl-4,5-dimethyl-6-phenyl-morpholin-3-one
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 247.157228918 u
Formula C15H21NO2
InChI InChI=1S/C15H21NO2/c1-10(2)13-15(17)16(4)11(3)14(18-13)12-8-6-5-7-9-12/h5-11,13-14H,1-4H3/t11-,13-,14-/m0/s1
InChIKey PKQDDMVFNLNWQG-UBHSHLNASA-N
Molecular Weight 247.338 g/mol
SMILES C1(N([C@]([C@](O[C@]1(C(C)C)[H])(C1=CC=CC=C1)[H])(C)[H])C)=O