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(3S,6R)-3-((1-(tert-Butyloxycarbonyl)-2-bromo-3-indoyl)methyl)-3,6-dihydro-6-isopropyl-2,5-diethoxypyrazine
SpectraBase Compound ID HYPQuRSxOZC
InChI InChI=1S/C25H34BrN3O4/c1-8-31-22-18(27-23(32-9-2)20(28-22)15(3)4)14-17-16-12-10-11-13-19(16)29(21(17)26)24(30)33-25(5,6)7/h10-13,15,18,20H,8-9,14H2,1-7H3/t18-,20+/m0/s1
InChIKey GRWIAXQYPPAUGY-AZUAARDMSA-N
Mol Weight 520.5 g/mol
Molecular Formula C25H34BrN3O4
Exact Mass 519.17327 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7gcduzqSiZJ
Name (3S,6R)-3-((1-(tert-Butyloxycarbonyl)-2-bromo-3-indoyl)methyl)-3,6-dihydro-6-isopropyl-2,5-diethoxypyrazine
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Formula C25H34BrN3O4
InChI InChI=1S/C25H34BrN3O4/c1-8-31-22-18(27-23(32-9-2)20(28-22)15(3)4)14-17-16-12-10-11-13-19(16)29(21(17)26)24(30)33-25(5,6)7/h10-13,15,18,20H,8-9,14H2,1-7H3/t18-,20+/m0/s1
InChIKey GRWIAXQYPPAUGY-AZUAARDMSA-N
Molecular Weight 520.468 g/mol
SMILES c1([n](c2c(c1C[C@@]1(N=C(OCC)[C@](N=C1OCC)(C(C)C)[H])[H])cccc2)C(OC(C)(C)C)=O)Br
SPLASH splash10-05mx-0944310000-d5fad90b68b9b77e0be8
Source of Spectrum J-62-7456-24
Synonyms tert-Butyl 2-bromo-3-{[(2S,5R)-3,6-diethoxy-5-isopropyl-2,5-dihydro-2-pyrazinyl]methyl}-1H-indole-1-carboxylate
Wiley ID 1401819