SpectraBase Compound ID | 1CDURpK78K6 |
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InChI | InChI=1S/C9H5N3O2S/c10-4-8-9(11)6-3-5(12(13)14)1-2-7(6)15-8/h1-3H,11H2 |
InChIKey | XTCMVQUQNXSABA-UHFFFAOYSA-N |
Mol Weight | 219.22 g/mol |
Molecular Formula | C9H5N3O2S |
Exact Mass | 219.010248 g/mol |
SpectraBase Spectrum ID | 3YX6jyjX7Sc |
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Name | Benzo[b]thiophene-2-carbonitrile, 3-amino-5-nitro- |
CAS Registry Number | 52673-94-6 |
Copyright | Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C9H5N3O2S |
InChI | InChI=1S/C9H5N3O2S/c10-4-8-9(11)6-3-5(12(13)14)1-2-7(6)15-8/h1-3H,11H2 |
InChIKey | XTCMVQUQNXSABA-UHFFFAOYSA-N |
Instrument Name | Bruker IFS 85 |
Technique | KBr-Pellet |