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5-(4-Methylphenoxy)methyl-2-amino-1,3,4-thiadiazoles
SpectraBase Compound ID 2qWvCSwx8FL
InChI InChI=1S/C10H11N3OS/c1-7-2-4-8(5-3-7)14-6-9-12-13-10(11)15-9/h2-5H,6H2,1H3,(H2,11,13)
InChIKey CTCPPJXVAHAECP-UHFFFAOYSA-N
Mol Weight 221.28 g/mol
Molecular Formula C10H11N3OS
Exact Mass 221.062283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 40EWKd41qWf
Name 5-(4-Methylphenoxy)methyl-2-amino-1,3,4-thiadiazoles
Alternate Name(s) 5-[(4-methylphenoxy)methyl]-1,3,4-thiadiazol-2-amine
Comments Less than 3 mono-isotopic peaks
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Formula C10H11N3OS
InChI InChI=1S/C10H11N3OS/c1-7-2-4-8(5-3-7)14-6-9-12-13-10(11)15-9/h2-5H,6H2,1H3,(H2,11,13)
InChIKey CTCPPJXVAHAECP-UHFFFAOYSA-N
Molecular Weight 221.278 g/mol
SMILES Nc1sc(nn1)COc1ccc(C)cc1
SPLASH splash10-0a4i-0090000000-d569a57f687b4dbc01d8
Source of Spectrum G2-19-217-5o
Wiley ID 1705322