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(4S,5S)-4-tert-Butyl-3-(1,7-dioxo-5-phenyloct-2-en-1-yl)tetrahydro-2-oxazolone
SpectraBase Compound ID 1nU6sjIPFgl
InChI InChI=1S/C21H27NO4/c1-15(23)13-17(16-9-6-5-7-10-16)11-8-12-19(24)22-18(21(2,3)4)14-26-20(22)25/h5-10,12,17-18H,11,13-14H2,1-4H3/b12-8+/t17-,18+/m0/s1
InChIKey QKWCWCXRLGIQHG-QGWFOHBRSA-N
Mol Weight 357.45 g/mol
Molecular Formula C21H27NO4
Exact Mass 357.194008 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID wOAQgU6KW
Name (4S,5S)-4-tert-Butyl-3-(1,7-dioxo-5-phenyloct-2-en-1-yl)tetrahydro-2-oxazolone
Alternate Name(s) (4S)-4-tert-butyl-3-[(2E,5S)-7-oxo-5-phenyl-2-octenoyl]-1,3-oxazolidin-2-one 4-tert-Butyl-3-(1,7-dioxo-5-phenyloct-2-en-1-yl)tetrahydro-2-oxazolone
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Formula C21H27NO4
InChI InChI=1S/C21H27NO4/c1-15(23)13-17(16-9-6-5-7-10-16)11-8-12-19(24)22-18(21(2,3)4)14-26-20(22)25/h5-10,12,17-18H,11,13-14H2,1-4H3/b12-8+/t17-,18+/m0/s1
InChIKey QKWCWCXRLGIQHG-QGWFOHBRSA-N
Molecular Weight 357.450 g/mol
SMILES C1(N([C@](CO1)(C(C)(C)C)[H])C(\C=C\C[C@@](CC(=O)C)(c1ccccc1)[H])=O)=O
SPLASH splash10-0bt9-0953000000-b6a54e247795ece4321d
Source of Spectrum QE-8-2590-2
Wiley ID 1557697