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(5R,7aS)-2-{[N-(Butoxycarbonyl)indol-3'-yl]methyl}-5-phenyl-2,5,6,7,7-pentahydro-6-oxapyrrolizin-3-one
SpectraBase Compound ID DbkYxm6R0sJ
InChI InChI=1S/C26H28N2O4/c1-26(2,3)32-25(30)27-15-19(21-11-7-8-12-22(21)27)13-18-14-20-16-31-24(28(20)23(18)29)17-9-5-4-6-10-17/h4-12,15,18,20,24H,13-14,16H2,1-3H3/t18?,20-,24+/m0/s1
InChIKey RTPQNKMPDCAKDU-XYJFARLGSA-N
Mol Weight 432.52 g/mol
Molecular Formula C26H28N2O4
Exact Mass 432.204907 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BAKkfZhvogq
Name (5R,7aS)-2-{[N-(Butoxycarbonyl)indol-3'-yl]methyl}-5-phenyl-2,5,6,7,7-pentahydro-6-oxapyrrolizin-3-one
Alternate Name(s) (5R,7aS)-2-{[N-(tert-Butoxycarbonyl)indol-3'-yl]methyl}-5-phenyl-2,5,6,7,7-pentahydro-6-oxapyrrolizin-3-one 2-{[N-(Butoxycarbonyl)indol-3'-yl]methyl}-5-phenyl-2,5,6,7,7-pentahydro-6-oxapyrrolizin-3-one 2-{[N-(tert-Butoxycarbonyl)indol-3'-yl]methyl}-5-phenyl-2,5,6,7,7-pentahydro-6-oxapyrrolizin-3-one tert-Butyl 3-{[(3R,7aS)-5-oxo-3-phenyltetrahydro-1H-pyrrolo[1,2-c][1,3]oxazol-6-yl]methyl}-1H-indole-1-carboxylate
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Formula C26H28N2O4
InChI InChI=1S/C26H28N2O4/c1-26(2,3)32-25(30)27-15-19(21-11-7-8-12-22(21)27)13-18-14-20-16-31-24(28(20)23(18)29)17-9-5-4-6-10-17/h4-12,15,18,20,24H,13-14,16H2,1-3H3/t18?,20-,24+/m0/s1
InChIKey RTPQNKMPDCAKDU-XYJFARLGSA-N
Molecular Weight 432.520 g/mol
SMILES C1(N2[C@@](CC1Cc1c[n](C(OC(C)(C)C)=O)c3c1cccc3)(CO[C@@]2(c1ccccc1)[H])[H])=O
SPLASH splash10-001i-1912100000-6dc876c8f5f9088d56e7
Source of Spectrum SK-30-2156-2
Wiley ID 881263