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3-[[(2R,5S)-3,6-diethoxy-5-isopropyl-2,5-dihydropyrazin-2-yl]methyl]-5-methoxy-indole-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID HEOSKlo8SLo
InChI InChI=1S/C26H37N3O5/c1-9-32-23-20(27-24(33-10-2)22(28-23)16(3)4)13-17-15-29(25(30)34-26(5,6)7)21-12-11-18(31-8)14-19(17)21/h11-12,14-16,20,22H,9-10,13H2,1-8H3/t20-,22+/m1/s1
InChIKey CVQJOXBZTGGHMY-IRLDBZIGSA-N
Mol Weight 471.6 g/mol
Molecular Formula C26H37N3O5
Exact Mass 471.273321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5zxseBgKLcp
Name 3-[[(2R,5S)-3,6-diethoxy-5-isopropyl-2,5-dihydropyrazin-2-yl]methyl]-5-methoxy-indole-1-carboxylic acid tert-butyl ester
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Formula C26H37N3O5
InChI InChI=1S/C26H37N3O5/c1-9-32-23-20(27-24(33-10-2)22(28-23)16(3)4)13-17-15-29(25(30)34-26(5,6)7)21-12-11-18(31-8)14-19(17)21/h11-12,14-16,20,22H,9-10,13H2,1-8H3/t20-,22+/m1/s1
InChIKey CVQJOXBZTGGHMY-IRLDBZIGSA-N
Molecular Weight 471.598 g/mol
SMILES C([n]1cc(C[C@]2(N=C(OCC)[C@@](N=C2OCC)(C(C)C)[H])[H])c2c1ccc(OC)c2)(OC(C)(C)C)=O
SPLASH splash10-03di-0960000000-f0693864c4cd4d97893b
Source of Spectrum F-68-6291-22
Synonyms 3-[[(2R,5S)-3,6-diethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-5-methoxy-1-indolecarboxylic acid tert-butyl ester tert-Butyl 3-[[(2R,5S)-3,6-diethoxy-5-isopropyl-2,5-dihydropyrazin-2-yl]methyl]-5-methoxy-indole-1-carboxylate tert-Butyl 3-[[(2R,5S)-3,6-diethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-5-methoxy-indole-1-carboxylate
Wiley ID 1573132