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3-(2,1,3-Benzothiadiazol-4-yl)aniline

View entire compound with spectra: 1 MS (GC)

3-(2,1,3-Benzothiadiazol-4-yl)aniline
SpectraBase Compound ID ENC6syYyrhA
InChI InChI=1S/C12H9N3S/c13-9-4-1-3-8(7-9)10-5-2-6-11-12(10)15-16-14-11/h1-7H,13H2
InChIKey BMXJUQYKDQARKT-UHFFFAOYSA-N
Mol Weight 227.28 g/mol
Molecular Formula C12H9N3S
Exact Mass 227.051718 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1XGqqBMm8BC
Name 3-(2,1,3-Benzothiadiazol-4-yl)aniline
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9N3S
InChI InChI=1S/C12H9N3S/c13-9-4-1-3-8(7-9)10-5-2-6-11-12(10)15-16-14-11/h1-7H,13H2
InChIKey BMXJUQYKDQARKT-UHFFFAOYSA-N
Molecular Weight 227.285 g/mol
SMILES Nc1cc(-c2c3nsnc3ccc2)ccc1
SPLASH splash10-004i-0090000000-b9e8008eda435faec0e3
Source of Spectrum F4-44-3470-4a
Synonyms 3-(benzo[c][1,2,5]thiadiazol-4-yl)aniline
Wiley ID 1736803