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Benzoic acid, 2-[[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]thio]-, methyl ester
SpectraBase Compound ID 17fS5IWw4lr
InChI InChI=1S/C17H14N2O3S/c1-21-17(20)13-9-5-6-10-14(13)23-11-15-18-16(19-22-15)12-7-3-2-4-8-12/h2-10H,11H2,1H3
InChIKey LLPBDVWZYKWHLW-UHFFFAOYSA-N
Mol Weight 326.37 g/mol
Molecular Formula C17H14N2O3S
Exact Mass 326.072513 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DY7ZgdNTbSF
Name Benzoic acid, 2-[[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]thio]-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H14N2O3S
InChI InChI=1S/C17H14N2O3S/c1-21-17(20)13-9-5-6-10-14(13)23-11-15-18-16(19-22-15)12-7-3-2-4-8-12/h2-10H,11H2,1H3
InChIKey LLPBDVWZYKWHLW-UHFFFAOYSA-N
Molecular Weight 326.370 g/mol
SMILES c1cc(C(OC)=O)c(cc1)SCc1onc(n1)-c1ccccc1
SPLASH splash10-004i-3920000000-ed8e1c62bd8231460ddd
Synonyms Methyl 2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoate
Wiley ID 1448777