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(4S)-3-(6-methyl-1-oxohept-6-enyl)-4-propan-2-yl-2-oxazolidinone
SpectraBase Compound ID F6Ep16kk80
InChI InChI=1S/C14H23NO3/c1-10(2)7-5-6-8-13(16)15-12(11(3)4)9-18-14(15)17/h11-12H,1,5-9H2,2-4H3/t12-/m1/s1
InChIKey COCZPACCGJGRAU-GFCCVEGCSA-N
Mol Weight 253.34 g/mol
Molecular Formula C14H23NO3
Exact Mass 253.167794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8jsWWrIvSz8
Name (4S)-3-(6-Methyl-1-oxohept-6-enyl)-4-propan-2-yl-2-oxazolidinone
Comments Computed using HOSE algorithm
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Exact Mass 253.167793602 u
Formula C14H23NO3
InChI InChI=1S/C14H23NO3/c1-10(2)7-5-6-8-13(16)15-12(11(3)4)9-18-14(15)17/h11-12H,1,5-9H2,2-4H3/t12-/m1/s1
InChIKey COCZPACCGJGRAU-GFCCVEGCSA-N
Molecular Weight 253.342 g/mol
SMILES C1(N([C@](CO1)(C(C)C)[H])C(=O)CCCCC(=C)C)=O