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copper(II) N-(diisobutylcarbamothioyl)benzimidate

View entire compound with spectra: 1 MS (GC)

copper(II) N-(diisobutylcarbamothioyl)benzimidate
SpectraBase Compound ID BbO1OG0gYse
InChI InChI=1S/2C16H24N2OS.Cu/c2*1-12(2)10-18(11-13(3)4)16(20)17-15(19)14-8-6-5-7-9-14;/h2*5-9,12-13H,10-11H2,1-4H3,(H,17,19,20);/q;;+2/p-2
InChIKey MQRKAEDSRJHLDM-UHFFFAOYSA-L
Mol Weight 646.41 g/mol
Molecular Formula C32H46CuN4O2S2
Exact Mass 645.235816 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CdTImTtJWPP
Name copper(II) N-(diisobutylcarbamothioyl)benzimidate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H46CuN4O2S2
InChI InChI=1S/2C16H24N2OS.Cu/c2*1-12(2)10-18(11-13(3)4)16(20)17-15(19)14-8-6-5-7-9-14;/h2*5-9,12-13H,10-11H2,1-4H3,(H,17,19,20);/q;;+2/p-2
InChIKey MQRKAEDSRJHLDM-UHFFFAOYSA-L
Molecular Weight 646.412 g/mol
SMILES C(N=C(c1ccccc1)[O-])(=S)N(CC(C)C)CC(C)C.[Cu+2].C(N=C(c1ccccc1)[O-])(=S)N(CC(C)C)CC(C)C
SPLASH splash10-0a4i-2930000000-ca4f0ba4908367248a65
Source of Spectrum DZ-464-165-6b
Wiley ID 1800340