SpectraBase Compound ID | IANUr5FHI7p |
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InChI | InChI=1S/C14H9NO2S/c16-13(10-6-2-1-3-7-10)15-14(17)11-8-4-5-9-12(11)18-15/h1-9H |
InChIKey | WHAFQSPDQFNSPQ-UHFFFAOYSA-N |
Mol Weight | 255.29 g/mol |
Molecular Formula | C14H9NO2S |
Exact Mass | 255.0354 g/mol |
SpectraBase Spectrum ID | AHMOwHolY0z |
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Name | 2-Benzoyl-benzisothiazol-3-one |
CAS Registry Number | 2527-04-0 |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C14H9NO2S |
InChI | InChI=1S/C14H9NO2S/c16-13(10-6-2-1-3-7-10)15-14(17)11-8-4-5-9-12(11)18-15/h1-9H |
InChIKey | WHAFQSPDQFNSPQ-UHFFFAOYSA-N |
Instrument Name | Bruker WM-250 |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | DMSO-D6 |