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2-[(3-methoxyphenyl)methylsulfanyl]-5-pyrazin-2-yl-1,3,4-oxadiazole
SpectraBase Compound ID KgZHhwWVPou
InChI InChI=1S/C14H12N4O2S/c1-19-11-4-2-3-10(7-11)9-21-14-18-17-13(20-14)12-8-15-5-6-16-12/h2-8H,9H2,1H3
InChIKey DIXPKHCSYVGFDR-UHFFFAOYSA-N
Mol Weight 300.34 g/mol
Molecular Formula C14H12N4O2S
Exact Mass 300.068097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2WGJ6doZqMd
Name 2-[(3-methoxyphenyl)methylsulfanyl]-5-pyrazin-2-yl-1,3,4-oxadiazole
Appearance Cream color solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12N4O2S
InChI InChI=1S/C14H12N4O2S/c1-19-11-4-2-3-10(7-11)9-21-14-18-17-13(20-14)12-8-15-5-6-16-12/h2-8H,9H2,1H3
InChIKey DIXPKHCSYVGFDR-UHFFFAOYSA-N
Instrument Name WATER's Micromass-QUATTRO-II
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3464
Molecular Weight 300.336 g/mol
SMILES c1(oc(nn1)SCc1cccc(c1)OC)-c1nccnc1
SPLASH splash10-0fk9-7921000000-c94b9a429559550776c8
Source of Spectrum Y-56-SM13-6b
Wiley ID 1859468