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(1R)-1-[(1RS,4R,8R)-8-(2-tert-Butoxyethyl)-1-hydroxy-4-phenylhexahydropyrrolo[2,1-c][1,4]oxazin-7-yl]ethanone
SpectraBase Compound ID Du6oyCWLnSY
InChI InChI=1S/C21H31NO4/c1-14(23)17-12-22-18(15-8-6-5-7-9-15)13-25-20(24)19(22)16(17)10-11-26-21(2,3)4/h5-9,16-20,24H,10-13H2,1-4H3/t16-,17?,18+,19?,20-/m1/s1
InChIKey BLRXFLUMEZDEQU-RJCIEPHCSA-N
Mol Weight 361.48 g/mol
Molecular Formula C21H31NO4
Exact Mass 361.225308 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7w3I4DHUqez
Name (1R)-1-[(1RS,4R,8R)-8-(2-tert-Butoxyethyl)-1-hydroxy-4-phenylhexahydropyrrolo[2,1-c][1,4]oxazin-7-yl]ethanone
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Formula C21H31NO4
InChI InChI=1S/C21H31NO4/c1-14(23)17-12-22-18(15-8-6-5-7-9-15)13-25-20(24)19(22)16(17)10-11-26-21(2,3)4/h5-9,16-20,24H,10-13H2,1-4H3/t16-,17?,18+,19?,20-/m1/s1
InChIKey BLRXFLUMEZDEQU-RJCIEPHCSA-N
Molecular Weight 361.482 g/mol
SMILES O[C@]1(C2N(CC(C(=O)C)[C@]2(CCOC(C)(C)C)[H])[C@@](CO1)(c1ccccc1)[H])[H]
SPLASH splash10-0udi-0913000000-3b55f3237706bf466021
Source of Spectrum J-59-7939-11
Synonyms 1-[(1R,4R,8R)-8-(2-tert-butoxyethyl)-1-hydroxy-4-phenylhexahydro-1H-pyrrolo[2,1-c][1,4]oxazin-7-yl]ethanone
Wiley ID 1349050