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4-benzyl-3-(pyridin-3-yl)-1,2,4-oxadiazole-5(4H)-thione
SpectraBase Compound ID IsdvXhJVY1t
InChI InChI=1S/C14H11N3OS/c19-14-17(10-11-5-2-1-3-6-11)13(16-18-14)12-7-4-8-15-9-12/h1-9H,10H2
InChIKey QSWMACSTHMNAGR-UHFFFAOYSA-N
Mol Weight 269.32 g/mol
Molecular Formula C14H11N3OS
Exact Mass 269.062283 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID MRHXiTHJfQ
Name 4-benzyl-3-(pyridin-3-yl)-1,2,4-oxadiazole-5(4H)-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H11N3OS
InChI InChI=1S/C14H11N3OS/c19-14-17(10-11-5-2-1-3-6-11)13(16-18-14)12-7-4-8-15-9-12/h1-9H,10H2
InChIKey QSWMACSTHMNAGR-UHFFFAOYSA-N
Instrument Name VG MM7070E
Ionization Type EI
Literature Reference DOI 10.1002_(SICI)1097-0231(19990415)13_7_625
Molecular Weight 269.322 g/mol
SMILES C1(N(C(=NO1)c1cccnc1)Cc1ccccc1)=S
SPLASH splash10-00kf-9530000000-7636d5c8d86d953d03c3
Source of Spectrum RCM-13-627-5
Wiley ID 1839063