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Ethyl (1R,6R)-2,2-Ethylenedioxy)-6-[2-[(2'S)-2'-(methoxymethyl)pyrrolidino]imino]-3-methylbutyl]cyclohexanecarboxylate
SpectraBase Compound ID HUIbbkWBho5
InChI InChI=1S/C22H38N2O5/c1-5-27-21(25)20-17(8-6-10-22(20)28-12-13-29-22)14-19(16(2)3)23-24-11-7-9-18(24)15-26-4/h16-18,20H,5-15H2,1-4H3/b23-19+/t17-,18+,20+/m1/s1
InChIKey PKYXVLZTIGJZEV-XNNQMXDSSA-N
Mol Weight 410.6 g/mol
Molecular Formula C22H38N2O5
Exact Mass 410.278072 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6rZjwyQplSo
Name Ethyl (1R,6R)-2,2-Ethylenedioxy)-6-[2-[(2'S)-2'-(methoxymethyl)pyrrolidino]imino]-3-methylbutyl]cyclohexanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H38N2O5
InChI InChI=1S/C22H38N2O5/c1-5-27-21(25)20-17(8-6-10-22(20)28-12-13-29-22)14-19(16(2)3)23-24-11-7-9-18(24)15-26-4/h16-18,20H,5-15H2,1-4H3/b23-19+/t17-,18+,20+/m1/s1
InChIKey PKYXVLZTIGJZEV-XNNQMXDSSA-N
Molecular Weight 410.555 g/mol
SMILES [C@]1(C2(OCCO2)CCC[C@@]1(C\C(=N/N1[C@](COC)(CCC1)[H])C(C)C)[H])(C(=O)OCC)[H]
SPLASH splash10-014i-7619100000-30ea911f319e9ce84cdc
Source of Spectrum SO-0-211-3
Wiley ID 873442