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3-Methyl-2-(pyridin-2-yloxy)phenyl thiophene-3-carboxylate
SpectraBase Compound ID IOPjL11dVwc
InChI InChI=1S/C17H13NO3S/c1-12-5-4-6-14(20-17(19)13-8-10-22-11-13)16(12)21-15-7-2-3-9-18-15/h2-11H,1H3
InChIKey OWOPDYGXQNSUJK-UHFFFAOYSA-N
Mol Weight 311.36 g/mol
Molecular Formula C17H13NO3S
Exact Mass 311.061614 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID RVhX5uuz9g
Name 3-Methyl-2-(pyridin-2-yloxy)phenyl thiophene-3-carboxylate
Appearance White solid
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Exact Mass 311.061614454 u
Formula C17H13NO3S
InChI InChI=1S/C17H13NO3S/c1-12-5-4-6-14(20-17(19)13-8-10-22-11-13)16(12)21-15-7-2-3-9-18-15/h2-11H,1H3
InChIKey OWOPDYGXQNSUJK-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201405071
Molecular Weight 311.355 g/mol
Quality 155
Reported Formula C17H13NO3S
SMILES C1=CC=CN=C1OC1=C(C=CC=C1C)OC(=O)C=1C=CSC1
SPLASH splash10-03e9-2900000000-eeb30ced7a576b7085c4
Source of Spectrum QE-21-SM10-3ao (DOI: 10.1002/chem.201405071)
Wiley ID 1907011