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(Sp)-4-(4,4-Dimethyl-4,5-dihydrooxazolyl)-12-hydroxymethyl[2.2]paracyclophane
SpectraBase Compound ID J6XVE4mguTa
InChI InChI=1S/C22H25NO2/c1-22(2)14-25-21(23-22)20-12-16-4-8-17-7-3-15(11-19(17)13-24)5-9-18(20)10-6-16/h3,6-7,10-12,24H,4-5,8-9,13-14H2,1-2H3
InChIKey QSHQNZDHLKZCNT-UHFFFAOYSA-N
Mol Weight 335.45 g/mol
Molecular Formula C22H25NO2
Exact Mass 335.188529 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KeRhGAAJ8fm
Name (Sp)-4-(4,4-Dimethyl-4,5-dihydrooxazolyl)-12-hydroxymethyl[2.2]paracyclophane
Comments Less than 3 mono-isotopic peaks
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Formula C22H25NO2
InChI InChI=1S/C22H25NO2/c1-22(2)14-25-21(23-22)20-12-16-4-8-17-7-3-15(11-19(17)13-24)5-9-18(20)10-6-16/h3,6-7,10-12,24H,4-5,8-9,13-14H2,1-2H3
InChIKey QSHQNZDHLKZCNT-UHFFFAOYSA-N
Molecular Weight 335.447 g/mol
SMILES OCc1c2CCc3cc(C4=NC(C)(C)CO4)c(cc3)CCc(c1)cc2
SPLASH splash10-0udr-0095000000-040b8b8f2d20fcd96a0f
Source of Spectrum KD-14-1739-0
Wiley ID 1636116