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Ethyl t-Butyl 3-(1'-benzyl-3'-indolyl)-4-(t-butoxycarbonyl)-2-nitroglutarate
SpectraBase Compound ID 3PfKDvtoTh3
InChI InChI=1S/C31H38N2O8/c1-8-39-27(34)25(28(35)40-30(2,3)4)24(26(33(37)38)29(36)41-31(5,6)7)22-19-32(18-20-14-10-9-11-15-20)23-17-13-12-16-21(22)23/h9-17,19,24-26H,8,18H2,1-7H3
InChIKey QNLVOGVEYQZZHC-UHFFFAOYSA-N
Mol Weight 566.7 g/mol
Molecular Formula C31H38N2O8
Exact Mass 566.262816 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DmF9ubq6j2Z
Name Ethyl t-Butyl 3-(1'-benzyl-3'-indolyl)-4-(t-butoxycarbonyl)-2-nitroglutarate
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Formula C31H38N2O8
InChI InChI=1S/C31H38N2O8/c1-8-39-27(34)25(28(35)40-30(2,3)4)24(26(33(37)38)29(36)41-31(5,6)7)22-19-32(18-20-14-10-9-11-15-20)23-17-13-12-16-21(22)23/h9-17,19,24-26H,8,18H2,1-7H3
InChIKey QNLVOGVEYQZZHC-UHFFFAOYSA-N
Molecular Weight 566.651 g/mol
SMILES c1(C(C(N(=O)=O)C(OC(C)(C)C)=O)C(C(OC(C)(C)C)=O)C(=O)OCC)c[n](Cc2ccccc2)c2c1cccc2
SPLASH splash10-052f-9001100000-8f2d5ca42cd5138c33ab
Source of Spectrum SK-26-3049-24
Synonyms 1,3-Ditert-butyl 1-ethyl 2-(1-benzyl-1H-indol-3-yl)-3-nitro-1,1,3-propanetricarboxylate
Wiley ID 867257