[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 Google Search
Mol Weight	124.2 g/mol
Molecular Formula	C7H4D2S
Exact Mass	124.031575 g/mol

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SpectraBase Spectrum ID	CW5xBxV3ubW
Name	[2,7-2H2]tropothione
Alternate Name(s)	2,7-dideuterio-1-cyclohepta-2,4,6-trienethione
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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
Wiley ID	1580509