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[2,7-D2]Tropothione
SpectraBase Compound ID Il7HB43TFCO
InChI InChI=1S/C7H6S/c8-7-5-3-1-2-4-6-7/h1-6H/i5D,6D
InChIKey CMVYSZNWUCYUQY-KCZCTXNHSA-N
Mol Weight 124.2 g/mol
Molecular Formula C7H4D2S
Exact Mass 124.031575 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CW5xBxV3ubW
Name [2,7-2H2]tropothione
Comments Less than 3 mono-isotopic peaks
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Formula C7H4D2S
InChI InChI=1S/C7H6S/c8-7-5-3-1-2-4-6-7/h1-6H/i5D,6D
InChIKey CMVYSZNWUCYUQY-KCZCTXNHSA-N
Molecular Weight 124.197 g/mol
SMILES C1(=S)C(=CC=CC=C1[D])[D]
SPLASH splash10-0089-9500000000-9059e1e225b41cb4284e
Source of Spectrum K-2001-2209-2
Synonyms 2,7-dideuterio-1-cyclohepta-2,4,6-trienethione
Wiley ID 1580509