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3-[[(2S,5R)-3,6-diethoxy-5-isopropyl-2,5-dihydropyrazin-2-yl]methyl]-6-methoxy-indole-1-carboxylic acid tert-butyl ester
SpectraBase Compound ID 3ArpCeoe4tf
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)21-14-18(31-8)11-12-19(17)21/h11-12,14-16,20,22H,9-10,13H2,1-8H3/t20-,22+/m0/s1
InChIKey DGVQCZMTYVJEBR-RBBKRZOGSA-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 ChnetiQvO2c
Name 3-[[(2S,5R)-3,6-diethoxy-5-isopropyl-2,5-dihydropyrazin-2-yl]methyl]-6-methoxy-indole-1-carboxylic acid tert-butyl ester
Alternate Name(s) 3-[[(2S,5R)-3,6-diethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-6-methoxy-1-indolecarboxylic acid tert-butyl ester tert-Butyl 3-[[(2S,5R)-3,6-diethoxy-5-isopropyl-2,5-dihydropyrazin-2-yl]methyl]-6-methoxy-indole-1-carboxylate tert-Butyl 3-[[(2S,5R)-3,6-diethoxy-5-propan-2-yl-2,5-dihydropyrazin-2-yl]methyl]-6-methoxy-indole-1-carboxylate
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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)21-14-18(31-8)11-12-19(17)21/h11-12,14-16,20,22H,9-10,13H2,1-8H3/t20-,22+/m0/s1
InChIKey DGVQCZMTYVJEBR-RBBKRZOGSA-N
Molecular Weight 471.598 g/mol
SMILES c12[n](cc(c2ccc(c1)OC)C[C@@]1(N=C(OCC)[C@](N=C1OCC)(C(C)C)[H])[H])C(OC(C)(C)C)=O
SPLASH splash10-03xr-3690400000-4c40f60ec7647aa3f16b
Source of Spectrum J-62-9302-20
Wiley ID 1393128