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[Pentacyclopentadienyl{4-(methoxycarbonyl)-5-(tosylamido)cobaltadithiolene}]complex
SpectraBase Compound ID FBYquadzmXw
InChI InChI=1S/C12H13NO5S3.C5H5.Co/c1-7-3-5-8(6-4-7)21(16,17)13-11(14)9(19)10(20)12(15)18-2;1-2-4-5-3-1;/h3-6,19-20H,1-2H3,(H,13,14);1-5H;/q;;+2/p-2/b10-9-;;
InChIKey XSNQUULEGYJYLW-XXAVUKJNSA-L
Mol Weight 469.43 g/mol
Molecular Formula C17H16CoNO5S3
Exact Mass 468.952255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DQaUti9P4G9
Name [Pentacyclopentadienyl{4-(methoxycarbonyl)-5-(tosylamido)cobaltadithiolene}]complex
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H16CoNO5S3
InChI InChI=1S/C12H13NO5S3.C5H5.Co/c1-7-3-5-8(6-4-7)21(16,17)13-11(14)9(19)10(20)12(15)18-2;1-2-4-5-3-1;/h3-6,19-20H,1-2H3,(H,13,14);1-5H;/q;;+2/p-2/b10-9-;;
InChIKey XSNQUULEGYJYLW-XXAVUKJNSA-L
Molecular Weight 469.430 g/mol
SMILES N(S(c1ccc(cc1)C)(=O)=O)C(C=1S[Co]2345([C@]6([C@@]5([C@@]4([C@@]2([C@@]36[H])[H])[H])[H])[H])SC1C(=O)OC)=O
SPLASH splash10-059f-8900000000-e02b9fe837be903c2bc4
Source of Spectrum AU-674-69-3
Wiley ID 1575686