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2-Tert-butyl-3,5-diphenyl-4-(methoxycarbonyl)dihydroisoxazole

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

2-Tert-butyl-3,5-diphenyl-4-(methoxycarbonyl)dihydroisoxazole
SpectraBase Compound ID 5HT0fTl2HDB
InChI InChI=1S/C21H23NO3/c1-21(2,3)22-18(15-11-7-5-8-12-15)17(20(23)24-4)19(25-22)16-13-9-6-10-14-16/h5-14,18H,1-4H3
InChIKey DBQNHKKBFUXWQL-UHFFFAOYSA-N
Mol Weight 337.42 g/mol
Molecular Formula C21H23NO3
Exact Mass 337.167794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LN44eEbzvbH
Name 2-Tert-butyl-3,5-diphenyl-4-(methoxycarbonyl)dihydroisoxazole
Comments Computed using HOSE algorithm
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Exact Mass 337.167793602 u
Formula C21H23NO3
InChI InChI=1S/C21H23NO3/c1-21(2,3)22-18(15-11-7-5-8-12-15)17(20(23)24-4)19(25-22)16-13-9-6-10-14-16/h5-14,18H,1-4H3
InChIKey DBQNHKKBFUXWQL-UHFFFAOYSA-N
Molecular Weight 337.419 g/mol
SMILES C1(=C(ON(C1C=1C=CC=CC1)C(C)(C)C)C1=CC=CC=C1)C(=O)OC