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2-Cobalta-1,3-dithiol, cyclopentadienyl-4-methoxycarbonyl-5-(methoxycarbonyl-trans-ethenthia)-
SpectraBase Compound ID KUPoFGaPPqP
InChI InChI=1S/C8H10O4S3.C5H5.Co/c1-11-5(9)3-4-15-8(14)6(13)7(10)12-2;1-2-4-5-3-1;/h3-4,13-14H,1-2H3;1-5H;/q;;+2/p-2/b4-3+,8-6+;;
InChIKey LBSWMFOSTMPIPU-VXBSOBFSSA-L
Mol Weight 383.32 g/mol
Molecular Formula C13H8CoO4S3
Exact Mass 382.891666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ESJuy5pIoZH
Name 2-Cobalta-1,3-dithiol, cyclopentadienyl-4-methoxycarbonyl-5-(methoxycarbonyl-trans-ethenthia)-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13CoO4S3
InChI InChI=1S/C8H10O4S3.C5H5.Co/c1-11-5(9)3-4-15-8(14)6(13)7(10)12-2;1-2-4-5-3-1;/h3-4,13-14H,1-2H3;1-5H;/q;;+2/p-2/b4-3+,8-6+;;
InChIKey LBSWMFOSTMPIPU-VXBSOBFSSA-L
Molecular Weight 383.316 g/mol
SMILES [C]1[C][C][C][C]1.C(=O)(C1=C(S[Co]S1)S\C=C\C(=O)OC)OC
SPLASH splash10-0076-2962000000-e440bd75d4d4aabee590
Source of Spectrum HE-1982-0-0
Wiley ID 1363568