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t-Butyl 1-(benzylamino)-3-[(t-butoxycarbonyl)methyl]-4-[2'-(t-butoxycarbonyl)ethenyl]-2-indanecarboxylate
SpectraBase Compound ID A2XLAlku2iN
InChI InChI=1S/C34H45NO6/c1-32(2,3)39-26(36)19-18-23-16-13-17-24-28(23)25(20-27(37)40-33(4,5)6)29(31(38)41-34(7,8)9)30(24)35-21-22-14-11-10-12-15-22/h10-19,25,29-30,35H,20-21H2,1-9H3/b19-18+
InChIKey IBWHCDXQCKVMCP-VHEBQXMUSA-N
Mol Weight 563.7 g/mol
Molecular Formula C34H45NO6
Exact Mass 563.324688 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8QUQYgaVTsU
Name t-Butyl 1-(benzylamino)-3-[(t-butoxycarbonyl)methyl]-4-[2'-(t-butoxycarbonyl)ethenyl]-2-indanecarboxylate
Alternate Name(s) tert-Butyl 1-(benzylamino)-3-(2-tert-butoxy-2-oxoethyl)-4-[(1E)-3-tert-butoxy-3-oxo-1-propenyl]-2-indanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H45NO6
InChI InChI=1S/C34H45NO6/c1-32(2,3)39-26(36)19-18-23-16-13-17-24-28(23)25(20-27(37)40-33(4,5)6)29(31(38)41-34(7,8)9)30(24)35-21-22-14-11-10-12-15-22/h10-19,25,29-30,35H,20-21H2,1-9H3/b19-18+
InChIKey IBWHCDXQCKVMCP-VHEBQXMUSA-N
Molecular Weight 563.735 g/mol
SMILES N(C1C(C(OC(C)(C)C)=O)C(c2c(\C=C\C(OC(C)(C)C)=O)cccc12)CC(OC(C)(C)C)=O)Cc1ccccc1
SPLASH splash10-00di-5911030000-cf8456d6bd774b6f20e3
Source of Spectrum U-1996-907-11
Wiley ID 768590