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3-mercapto-1H-pyridin-2-one
SpectraBase Compound ID FFPnKEXTej6
InChI InChI=1S/C5H5NOS/c7-5-4(8)2-1-3-6-5/h1-3,8H,(H,6,7)
InChIKey CFQVMMFFPCCTPS-UHFFFAOYSA-N
Mol Weight 127.16 g/mol
Molecular Formula C5H5NOS
Exact Mass 127.009185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8WK6CI6W3zk
Name 3-mercapto-1H-pyridin-2-one
Alternate Name(s) 3-mercapto-2-pyridone 3-sulfanyl-1H-pyridin-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C5H5NOS
InChI InChI=1S/C5H5NOS/c7-5-4(8)2-1-3-6-5/h1-3,8H,(H,6,7)
InChIKey CFQVMMFFPCCTPS-UHFFFAOYSA-N
Molecular Weight 127.161 g/mol
SMILES N1C=CC=C(C1=O)S
SPLASH splash10-004i-1900000000-0a11022d0e2485db7d99
Source of Spectrum J-61-664-1
Wiley ID 1130563