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5-Phenyl-3-(prop-2-ynylthio)-1H-1,2,4-triazole

View entire compound with spectra: 1 MS (GC)

5-Phenyl-3-(prop-2-ynylthio)-1H-1,2,4-triazole
SpectraBase Compound ID 2jqIApx48qo
InChI InChI=1S/C11H9N3S/c1-2-8-15-11-12-10(13-14-11)9-6-4-3-5-7-9/h1,3-7H,8H2,(H,12,13,14)
InChIKey BOAHUXKIPLRPJN-UHFFFAOYSA-N
Mol Weight 215.27 g/mol
Molecular Formula C11H9N3S
Exact Mass 215.051718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ADsPCb4Ek3O
Name 5-Phenyl-3-(prop-2-ynylthio)-1H-1,2,4-triazole
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H9N3S
InChI InChI=1S/C11H9N3S/c1-2-8-15-11-12-10(13-14-11)9-6-4-3-5-7-9/h1,3-7H,8H2,(H,12,13,14)
InChIKey BOAHUXKIPLRPJN-UHFFFAOYSA-N
Molecular Weight 215.274 g/mol
SMILES [nH]1nc(nc1-c1ccccc1)SCC#C
SPLASH splash10-016r-6190000000-6a3b19fb8db3da8d34f9
Source of Spectrum SK-29-4421-2
Synonyms 5-Phenyl-3-(propargylthio)-1H-1,2,4-triazole 5-Phenyl-3-prop-2-ynylsulfanyl-1H-1,2,4-triazole
Wiley ID 880974