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3,4-bis(Hydroxymethyl)-5-phenyl-4,5-dihydro-1,2-oxazole

View entire compound with spectra: 1 MS (GC)

3,4-bis(Hydroxymethyl)-5-phenyl-4,5-dihydro-1,2-oxazole
SpectraBase Compound ID 3gw5UBdoU8O
InChI InChI=1S/C11H13NO3/c13-6-9-10(7-14)12-15-11(9)8-4-2-1-3-5-8/h1-5,9,11,13-14H,6-7H2/t9-,11+/m1/s1
InChIKey ZYUUIDQYXPNOLW-KOLCDFICSA-N
Mol Weight 207.23 g/mol
Molecular Formula C11H13NO3
Exact Mass 207.089543 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KhjbkONOQGc
Name 3,4-bis(Hydroxymethyl)-5-phenyl-4,5-dihydro-1,2-oxazole
Alternate Name(s) (4S,5R)-3,4-bis(Hydroxymethyl)-5-phenyl-4,5-dihydro-1,2-oxazole [3-(hydroxymethyl)-5-phenyl-4,5-dihydro-4-isoxazolyl]methanol [(4S,5R)-3-(hydroxymethyl)-5-phenyl-4,5-dihydroisoxazol-4-yl]methanol [(4S,5R)-3-(hydroxymethyl)-5-phenyl-4,5-dihydro-1,2-oxazol-4-yl]methanol
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Formula C11H13NO3
InChI InChI=1S/C11H13NO3/c13-6-9-10(7-14)12-15-11(9)8-4-2-1-3-5-8/h1-5,9,11,13-14H,6-7H2/t9-,11+/m1/s1
InChIKey ZYUUIDQYXPNOLW-KOLCDFICSA-N
Molecular Weight 207.229 g/mol
SMILES OCC=1[C@@](CO)([C@@](ON1)(c1ccccc1)[H])[H]
SPLASH splash10-00di-9200000000-5109e73d736e340fe1af
Source of Spectrum D1-1997-1210-12
Wiley ID 834991