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Benzyl 2rac-(2S,3aR,4S,7aS)-(Furan-2-yl)-4-[methoxy(methyl)carbamoyl]-2,3,3a,4,5,7a-hexahydro-1H-indole-1-carboxylate
SpectraBase Compound ID I9uMEwSuxQq
InChI InChI=1S/C23H26N2O5/c1-24(28-2)22(26)17-10-6-11-19-18(17)14-20(21-12-7-13-29-21)25(19)23(27)30-15-16-8-4-3-5-9-16/h3-9,11-13,17-20H,10,14-15H2,1-2H3/t17-,18+,19-,20-/m0/s1
InChIKey TXGKAMVJNCSVSJ-YRPNKDGESA-N
Mol Weight 410.47 g/mol
Molecular Formula C23H26N2O5
Exact Mass 410.184172 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HkgXJcMIwuA
Name Benzyl 2rac-(2S,3aR,4S,7aS)-(Furan-2-yl)-4-[methoxy(methyl)carbamoyl]-2,3,3a,4,5,7a-hexahydro-1H-indole-1-carboxylate
Alternate Name(s) (2S,3aR,4S,7aS)-2-(2-furanyl)-4-[[methoxy(methyl)amino]-oxomethyl]-2,3,3a,4,5,7a-hexahydroindole-1-carboxylic acid (phenylmethyl) ester benzyl (2S,3aR,4S,7aS)-2-(furan-2-yl)-4-[methoxy(methyl)carbamoyl]-2,3,3a,4,5,7a-hexahydroindole-1-carboxylate benzyl (2S,3aR,4S,7aS)-2-(2-furyl)-4-[methoxy(methyl)carbamoyl]-2,3,3a,4,5,7a-hexahydroindole-1-carboxylate (phenylmethyl) (2S,3aR,4S,7aS)-2-(furan-2-yl)-4-[methoxy(methyl)carbamoyl]-2,3,3a,4,5,7a-hexahydroindole-1-carboxylate
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Formula C23H26N2O5
InChI InChI=1S/C23H26N2O5/c1-24(28-2)22(26)17-10-6-11-19-18(17)14-20(21-12-7-13-29-21)25(19)23(27)30-15-16-8-4-3-5-9-16/h3-9,11-13,17-20H,10,14-15H2,1-2H3/t17-,18+,19-,20-/m0/s1
InChIKey TXGKAMVJNCSVSJ-YRPNKDGESA-N
Molecular Weight 410.470 g/mol
SMILES [C@@]12(N([C@@](C[C@@]2([C@@](C(N(OC)C)=O)(CC=C1)[H])[H])(c1occc1)[H])C(OCc1ccccc1)=O)[H]
SPLASH splash10-001l-9012000000-65b43badab9ee01ea574
Source of Spectrum U1-2011-6563-26
Wiley ID 1703052