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1,2-Benzisoxazole

View entire compound with spectra: 12 NMR, 5 FTIR, 2 Raman, and 2 MS (GC)

1,2-Benzisoxazole
SpectraBase Compound ID DAdt7m2Legb
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

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4dDX41Nyz0q
Name BENZO-[D]-ISOXAZOL
CAS Registry Number 271-95-4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. 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
Literature Reference Author L.STEFANIAK
Literature Reference Citation ORG.MAGN.RES.,11,385(1978)
Literature Reference DOI 10.1002/mrc.1270110804
Molecular Weight 119.123 g/mol
Solvent ACETONE-D6
Source File Reference UNIW1708