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2-[(4'-Hydroxycarbonyl)phenyl]-3-(thiomethyl)-3-thioxopropanaldehyde
SpectraBase Compound ID 5X5gprLMCcg
InChI InChI=1S/C11H10O3S2/c1-16-11(15)9(6-12)7-2-4-8(5-3-7)10(13)14/h2-6,9H,1H3,(H,13,14)
InChIKey MCLYLHSHTBWSPO-UHFFFAOYSA-N
Mol Weight 254.32 g/mol
Molecular Formula C11H10O3S2
Exact Mass 254.007137 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H5VrORj97oc
Name 2-[(4'-Hydroxycarbonyl)phenyl]-3-(thiomethyl)-3-thioxopropanaldehyde
Alternate Name(s) 4-[1-formyl-2-(methylsulfanyl)-2-thioxoethyl]benzoic acid
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Formula C11H10O3S2
InChI InChI=1S/C11H10O3S2/c1-16-11(15)9(6-12)7-2-4-8(5-3-7)10(13)14/h2-6,9H,1H3,(H,13,14)
InChIKey MCLYLHSHTBWSPO-UHFFFAOYSA-N
Molecular Weight 254.318 g/mol
SMILES OC(c1ccc(C(C(=S)SC)C=O)cc1)=O
SPLASH splash10-052f-9720000000-ed284084aa71ce6437b2
Source of Spectrum AC-132-633-22
Wiley ID 811881