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3-(4-Methoxyphenyl)-4-oxidanidyl-1,2,4-thiadiazol-4-ium-5-carbonitrile
SpectraBase Compound ID 3uTBd0yVChH
InChI InChI=1S/C10H7N3O2S/c1-15-8-4-2-7(3-5-8)10-12-16-9(6-11)13(10)14/h2-5H,1H3
InChIKey BNRHZWUABPCXEL-UHFFFAOYSA-N
Mol Weight 233.24 g/mol
Molecular Formula C10H7N3O2S
Exact Mass 233.025898 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2yjDmFZnJA
Name 3-(4-Methoxyphenyl)-4-oxidanidyl-1,2,4-thiadiazol-4-ium-5-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H7N3O2S
InChI InChI=1S/C10H7N3O2S/c1-15-8-4-2-7(3-5-8)10-12-16-9(6-11)13(10)14/h2-5H,1H3
InChIKey BNRHZWUABPCXEL-UHFFFAOYSA-N
Molecular Weight 233.245 g/mol
SMILES c1([n+](c(sn1)C#N)[O-])-c1ccc(cc1)OC
SPLASH splash10-00lr-0970000000-f962ac078894da01e9d5
Source of Spectrum KC-0-2247-11
Synonyms 3-(4-Methoxyphenyl)-4-oxido-1,2,4-thiadiazol-4-ium-5-carbonitrile
Wiley ID 828781