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3-Acetoxymethyl-6-benzyloxy-1-t-butoxycarbonyl-2,3-dihydro-5-nitro-1H-indole
SpectraBase Compound ID 8BN8VfuYktn
InChI InChI=1S/C23H26N2O7/c1-15(26)30-14-17-12-24(22(27)32-23(2,3)4)19-11-21(20(25(28)29)10-18(17)19)31-13-16-8-6-5-7-9-16/h5-11,17H,12-14H2,1-4H3
InChIKey PKQVNKDAZBGELR-UHFFFAOYSA-N
Mol Weight 442.47 g/mol
Molecular Formula C23H26N2O7
Exact Mass 442.174001 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HYvFMnVMSUh
Name 3-Acetoxymethyl-6-benzyloxy-1-t-butoxycarbonyl-2,3-dihydro-5-nitro-1H-indole
Alternate Name(s) tert-Butyl 3-[(acetyloxy)methyl]-6-(benzyloxy)-5-nitro-1-indolinecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H26N2O7
InChI InChI=1S/C23H26N2O7/c1-15(26)30-14-17-12-24(22(27)32-23(2,3)4)19-11-21(20(25(28)29)10-18(17)19)31-13-16-8-6-5-7-9-16/h5-11,17H,12-14H2,1-4H3
InChIKey PKQVNKDAZBGELR-UHFFFAOYSA-N
Molecular Weight 442.468 g/mol
SMILES c12N(CC(c2cc(c(c1)OCc1ccccc1)N(=O)=O)COC(=O)C)C(OC(C)(C)C)=O
SPLASH splash10-0006-9001400000-349e3c8bba4ce81b0f2e
Source of Spectrum F-50-2802-28
Wiley ID 1385277