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(2'S,5S)-(-)-5-BUTYL-4-[2-[METHOXY-(DIPHENYL)-METHYL]-TETRAHYDRO-1H-1-PYRROLYL]-5-METHYL-3-PHENYL-4,5-DIHYDRO-1,2,4-OXADIAZOLE
SpectraBase Compound ID CXtnWLACBJL
InChI InChI=1S/C31H37N3O2/c1-4-5-23-30(2)34(29(32-36-30)25-16-9-6-10-17-25)33-24-15-22-28(33)31(35-3,26-18-11-7-12-19-26)27-20-13-8-14-21-27/h6-14,16-21,28H,4-5,15,22-24H2,1-3H3/t28-,30-/m0/s1
InChIKey PGZCNUFRFCWOJP-JDXGNMNLSA-N
Mol Weight 483.7 g/mol
Molecular Formula C31H37N3O2
Exact Mass 483.288577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DiZoixUnRXE
Name (2'S,5S)-(-)-5-Butyl-4-{2-[methoxy(diphenyl)methyl]tetrahydro-1H-pyrrolyl}-5-methyl-3-phenyl-4,5-dihydro-1,2,4-oxadiazole
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Formula C31H37N3O2
InChI InChI=1S/C31H37N3O2/c1-4-5-23-30(2)34(29(32-36-30)25-16-9-6-10-17-25)33-24-15-22-28(33)31(35-3,26-18-11-7-12-19-26)27-20-13-8-14-21-27/h6-14,16-21,28H,4-5,15,22-24H2,1-3H3/t28-,30-/m0/s1
InChIKey PGZCNUFRFCWOJP-JDXGNMNLSA-N
Molecular Weight 483.656 g/mol
SMILES [C@]1(N(N2C(=NO[C@]2(CCCC)C)c2ccccc2)CCC1)(C(c1ccccc1)(c1ccccc1)OC)[H]
SPLASH splash10-052b-3900000000-267b32dd74b51c2ec800
Source of Spectrum H1-50-1019-7
Synonyms (2'S,5S/R)-(-)-5-Butyl-4-{2-[methoxy(diphenyl)methyl]tetrahydro-1H-pyrrolyl}-5-methyl-3-phenyl-4,5-dihydro-1,2,4-oxadiazole (5S)-5-butyl-4-{(2S)-2-[methoxy(diphenyl)methyl]pyrrolidinyl}-5-methyl-3-phenyl-4,5-dihydro-1,2,4-oxadiazole [(2S)-1-((5S)-5-butyl-5-methyl-3-phenyl-1,2,4-oxadiazol-4(5H)-yl)pyrrolidinyl](diphenyl)methyl methyl ether
Wiley ID 816953