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(S)-2-(1-Chloro-2-methylpropan-2-yl)-4-isopropyl-5,5-diphenyl-4,5-dihydrooxazole
SpectraBase Compound ID GmRGhxEHsyF
InChI InChI=1S/C22H26ClNO/c1-16(2)19-22(17-11-7-5-8-12-17,18-13-9-6-10-14-18)25-20(24-19)21(3,4)15-23/h5-14,16,19H,15H2,1-4H3/t19-/m0/s1
InChIKey MTHRSLOSRLUAPH-IBGZPJMESA-N
Mol Weight 355.91 g/mol
Molecular Formula C22H26ClNO
Exact Mass 355.170292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID h31HQEQLo3
Name (S)-2-(1-Chloro-2-methylpropan-2-yl)-4-isopropyl-5,5-diphenyl-4,5-dihydrooxazole
Appearance Yellow oil
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Formula C22H26ClNO
InChI InChI=1S/C22H26ClNO/c1-16(2)19-22(17-11-7-5-8-12-17,18-13-9-6-10-14-18)25-20(24-19)21(3,4)15-23/h5-14,16,19H,15H2,1-4H3/t19-/m0/s1
InChIKey MTHRSLOSRLUAPH-IBGZPJMESA-N
Instrument Name VG70-250 or HP6890-5970A or Shimadzu GC-MS-QP2010 SE
Ionization Type EI
Literature Reference DOI 10.3762/bjoc.12.114
Molecular Weight 355.909 g/mol
Optical Rotation [a]D20 = -313.3 (c = 0.93, CHCl3)
Reported Formula C22H26ClNO
SMILES C(C(C1=N[C@](C(O1)(c1ccccc1)c1ccccc1)(C(C)C)[H])(C)C)Cl
SPLASH splash10-0a4i-3519000000-a921f04b58cfc20097c7
Source of Spectrum BJO-12-SM7-9
Wiley ID 1854237