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(3E)-1-methyl-2-sulfanylidene-3-pyridinecarboxaldehyde oxime
SpectraBase Compound ID 3cCwE7i31X4
InChI InChI=1S/C7H8N2OS/c1-9-4-2-3-6(5-8-10)7(9)11/h2-5,10H,1H3/b8-5+
InChIKey HEBPVSVODQSLQE-VMPITWQZSA-N
Mol Weight 168.21 g/mol
Molecular Formula C7H8N2OS
Exact Mass 168.035734 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ICSZhFKB51R
Name (3E)-1-methyl-2-sulfanylidene-3-pyridinecarboxaldehyde oxime
Alternate Name(s) (3E)-1-methyl-2-thioxo-nicotinaldehyde oxime (3E)-1-methyl-2-thioxo-pyridine-3-carbaldehyde oxime 3-[(E)-hydroxyiminomethyl]-1-methyl-pyridine-2-thione
CAS Registry Number 91540-43-1
Comments Less than 3 mono-isotopic peaks
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Formula C7H8N2OS
InChI InChI=1S/C7H8N2OS/c1-9-4-2-3-6(5-8-10)7(9)11/h2-5,10H,1H3/b8-5+
InChIKey HEBPVSVODQSLQE-VMPITWQZSA-N
Molecular Weight 168.214 g/mol
SMILES O\N=C\C=1C(N(C=CC1)C)=S
SPLASH splash10-0udi-0900000000-80b1210adb0883b17a2b
Source of Spectrum Y-21-41-1
Wiley ID 1164004