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2-tert-Butyl-3-benzothiazol-2-yl-5-phenoxymethyl-2,3-dihydro-isoxazole
SpectraBase Compound ID IMiXKog4zDy
InChI InChI=1S/C21H22N2O2S/c1-21(2,3)23-18(20-22-17-11-7-8-12-19(17)26-20)13-16(25-23)14-24-15-9-5-4-6-10-15/h4-13,18H,14H2,1-3H3
InChIKey BWCRRKPTLZLFGF-UHFFFAOYSA-N
Mol Weight 366.48 g/mol
Molecular Formula C21H22N2O2S
Exact Mass 366.140199 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45ZGkJEN8q
Name 2-tert-Butyl-3-benzothiazol-2-yl-5-phenoxymethyl-2,3-dihydro-isoxazole
Appearance Yellow oil
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Formula C21H22N2O2S
InChI InChI=1S/C21H22N2O2S/c1-21(2,3)23-18(20-22-17-11-7-8-12-19(17)26-20)13-16(25-23)14-24-15-9-5-4-6-10-15/h4-13,18H,14H2,1-3H3
InChIKey BWCRRKPTLZLFGF-UHFFFAOYSA-N
Instrument Name Agilent Technologies 6850 Series II-5973 Network
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0010.e27
Molecular Weight 366.479 g/mol
Reported Formula C21H22N2O2S
SMILES C(Oc1ccccc1)C1=CC(N(O1)C(C)(C)C)c1sc2c(n1)cccc2
SPLASH splash10-0pb9-0091000000-cf8f6932c2fa4f57f7d9
Source of Spectrum ARK-2009-332-1e
Wiley ID 1869908