SpectraBase Compound ID | DAdt7m2Legb |
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InChI | InChI=1S/C7H5NO/c1-2-4-7-6(3-1)5-8-9-7/h1-5H |
InChIKey | KTZQTRPPVKQPFO-UHFFFAOYSA-N |
Mol Weight | 119.12 g/mol |
Molecular Formula | C7H5NO |
Exact Mass | 119.037114 g/mol |
SpectraBase Spectrum ID | 7B8gqx8Xhc3 |
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Name | Benzo(D)isoxazole |
CAS Registry Number | 271-95-4 |
Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula | C7H5NO |
InChI | InChI=1S/C7H5NO/c1-2-4-7-6(3-1)5-8-9-7/h1-5H |
InChIKey | KTZQTRPPVKQPFO-UHFFFAOYSA-N |
Instrument Name | Jeol FX-100 |
Literature Reference | P.G. Tsoungas, B.F. De Costa, Magn. Res. Chem. 26, 8 (1988). |
NMR Standard | TMS |
Origin | Chemical Concepts. A Wiley Division. Weinheim, Germany |
Solvent | CDCl3 |