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Pentacarbonyl{(2E)-1-ethoxy-3-[(2'S)-(2'-methoxycarbonyl)pyrrolidin-1'-yl]-2-hexen-1-ylidene}chromoum
SpectraBase Compound ID 57E0GTgKisM
InChI InChI=1S/C14H23NO3.5CO.Cr/c1-4-7-12(9-11-18-5-2)15-10-6-8-13(15)14(16)17-3;5*1-2;/h9,13H,4-8,10H2,1-3H3;;;;;;/b12-9+;;;;;;/t13-;;;;;;/m0....../s1
InChIKey IFXTZJGNAYVHCG-NUDSBGGBSA-N
Mol Weight 445.39 g/mol
Molecular Formula C19H23CrNO8
Exact Mass 445.082872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZwgWJS7xwK
Name Pentacarbonyl{(2E)-1-ethoxy-3-[(2'S)-(2'-methoxycarbonyl)pyrrolidin-1'-yl]-2-hexen-1-ylidene}chromoum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H23CrNO8
InChI InChI=1S/C14H23NO3.5CO.Cr/c1-4-7-12(9-11-18-5-2)15-10-6-8-13(15)14(16)17-3;5*1-2;/h9,13H,4-8,10H2,1-3H3;;;;;;/b12-9+;;;;;;/t13-;;;;;;/m0....../s1
InChIKey IFXTZJGNAYVHCG-NUDSBGGBSA-N
Molecular Weight 445.388 g/mol
SMILES C(=[Cr](C#[O])(C#[O])(C#[O])(C#[O])C#[O])(\C=C/(N1[C@](C(=O)OC)(CCC1)[H])CCC)OCC
SPLASH splash10-0r29-6389200000-7914eba7fafb5b491db2
Source of Spectrum K1-2004-733-3
Wiley ID 1560290