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(+)-(S,4Rp,13Sp)-4-Hydroxy-13-(4-tert-butyloxazolin-2-yl)[2.2]paracyclophane
SpectraBase Compound ID HvWDIYm3Xb0
InChI InChI=1S/C23H27NO2/c1-23(2,3)21-14-26-22(24-21)19-12-15-4-5-16-7-9-18(20(25)13-16)11-10-17(19)8-6-15/h6-9,12-13,21,25H,4-5,10-11,14H2,1-3H3/t21-/m1/s1
InChIKey YGHCVNPFLDCBRD-OAQYLSRUSA-N
Mol Weight 349.47 g/mol
Molecular Formula C23H27NO2
Exact Mass 349.204179 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2q1NX6j06uJ
Name (+)-(S,4Rp,13Sp)-4-Hydroxy-13-(4-tert-butyloxazolin-2-yl)[2.2]paracyclophane
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Formula C23H27NO2
InChI InChI=1S/C23H27NO2/c1-23(2,3)21-14-26-22(24-21)19-12-15-4-5-16-7-9-18(20(25)13-16)11-10-17(19)8-6-15/h6-9,12-13,21,25H,4-5,10-11,14H2,1-3H3/t21-/m1/s1
InChIKey YGHCVNPFLDCBRD-OAQYLSRUSA-N
Literature Reference DOI 10.1002/adsc.200600233
Molecular Weight 349.474 g/mol
SMILES Oc1c2CCc3ccc(CCc(c1)cc2)cc3C=1OC[C@@](N1)(C(C)(C)C)[H]
SPLASH splash10-0032-0395000000-cf16e52ff66e9271b3e1
Source of Spectrum ASC-348-2099-13
Wiley ID 1764971