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(1S,2S)-1-[4'-(S)-tert-Butyloxazolin-2'-yl]-2-[4"-(R)-phenyloxazolin-2"-yl]cyclopentane
SpectraBase Compound ID 5eeToqxWK31
InChI InChI=1S/C21H28N2O2/c1-21(2,3)18-13-25-20(23-18)16-11-7-10-15(16)19-22-17(12-24-19)14-8-5-4-6-9-14/h4-6,8-9,15-18H,7,10-13H2,1-3H3/t15-,16-,17-,18+/m0/s1
InChIKey BEOFPEJCEAKJAT-XLAORIBOSA-N
Mol Weight 340.47 g/mol
Molecular Formula C21H28N2O2
Exact Mass 340.215078 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ILDUxf8cKAf
Name (1S,2S)-1-[4'-(S)-tert-Butyloxazolin-2'-yl]-2-[4"-(R)-phenyloxazolin-2"-yl]cyclopentane
Alternate Name(s) (1S,2S)-[4'-(S)-tert-Butyloxazolin-2'-yl]-[4''-(R)-phenyloxazolin-2''-yl]cyclopentane (4R)-2-{(1S,2S)-2-[(4S)-4-tert-butyl-4,5-dihydro-1,3-oxazol-2-yl]cyclopentyl}-4-phenyl-4,5-dihydro-1,3-oxazole
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Formula C21H28N2O2
InChI InChI=1S/C21H28N2O2/c1-21(2,3)18-13-25-20(23-18)16-11-7-10-15(16)19-22-17(12-24-19)14-8-5-4-6-9-14/h4-6,8-9,15-18H,7,10-13H2,1-3H3/t15-,16-,17-,18+/m0/s1
InChIKey BEOFPEJCEAKJAT-XLAORIBOSA-N
Molecular Weight 340.467 g/mol
SMILES C1(=N[C@](c2ccccc2)(CO1)[H])[C@@]1([C@@](C2=N[C@@](C(C)(C)C)(CO2)[H])(CCC1)[H])[H]
SPLASH splash10-03ei-1971000000-135a939e83af982da322
Source of Spectrum QC-17-631-25
Wiley ID 1638123