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1,2-Epoxy-1-(4'-methoxymethyl)-5'-phenyl-2'-oxazolin-2'-yl)-3-methylbutane
SpectraBase Compound ID BlQoLMPNBcX
InChI InChI=1S/C16H21NO3/c1-10(2)13-15(19-13)16-17-12(9-18-3)14(20-16)11-7-5-4-6-8-11/h4-8,10,12-15H,9H2,1-3H3/t12-,13+,14-,15-/m0/s1
InChIKey OENSQGBMHAXLET-XGUBFFRZSA-N
Mol Weight 275.35 g/mol
Molecular Formula C16H21NO3
Exact Mass 275.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DKn3WTFtCPM
Name 1,2-Epoxy-1-(4'-methoxymethyl)-5'-phenyl-2'-oxazolin-2'-yl)-3-methylbutane
Alternate Name(s) (4S,5S)-4-(methoxymethyl)-5-phenyl-2-[(2S,3R)-3-propan-2-yl-2-oxiranyl]-4,5-dihydrooxazole (4S,5S)-2-[(2S,3R)-3-isopropyloxiran-2-yl]-4-(methoxymethyl)-5-phenyl-4,5-dihydrooxazole (4S,5S)-4-(methoxymethyl)-5-phenyl-2-[(2S,3R)-3-propan-2-yloxiran-2-yl]-4,5-dihydro-1,3-oxazole
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Formula C16H21NO3
InChI InChI=1S/C16H21NO3/c1-10(2)13-15(19-13)16-17-12(9-18-3)14(20-16)11-7-5-4-6-8-11/h4-8,10,12-15H,9H2,1-3H3/t12-,13+,14-,15-/m0/s1
InChIKey OENSQGBMHAXLET-XGUBFFRZSA-N
Molecular Weight 275.348 g/mol
SMILES [C@@]1(C2=N[C@@](COC)([C@@](O2)(c2ccccc2)[H])[H])(O[C@@]1(C(C)C)[H])[H]
SPLASH splash10-004i-0900000000-39d2e28e77e585742b30
Source of Spectrum K1-2001-2038-7
Wiley ID 846276