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1-OXO-3-METHYL-3-ETHYLBENZO[C]ISOXAZOLINIUM BISULPHATE

View entire compound with spectra: 1 NMR

1-OXO-3-METHYL-3-ETHYLBENZO[C]ISOXAZOLINIUM BISULPHATE
SpectraBase Compound ID 89JP2IODF1X
InChI InChI=1S/C10H12NO2.H2O4S/c1-3-10(2)8-6-4-5-7-9(8)11(12)13-10;1-5(2,3)4/h4-7H,3H2,1-2H3;(H2,1,2,3,4)/q+1;/p-1
InChIKey VVCYPGJBOJLTAP-UHFFFAOYSA-M
Mol Weight 275.27 g/mol
Molecular Formula C10H13NO6S
Exact Mass 275.046358 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8W0ACYCs8b
Name 1-OXO-3-METHYL-3-ETHYLBENZO[C]ISOXAZOLINIUM BISULPHATE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H13NO6S
InChI InChI=1S/C10H12NO2.H2O4S/c1-3-10(2)8-6-4-5-7-9(8)11(12)13-10;1-5(2,3)4/h4-7H,3H2,1-2H3;(H2,1,2,3,4)/q+1;/p-1
InChIKey VVCYPGJBOJLTAP-UHFFFAOYSA-M
Instrument Name Varian XL-100
Literature Reference V.I.DAINEKO, V.A.CHERTKOV, S.S.MOCHALOV, YU.S.SHABAROV (1974)Zhurn.Org.Khim.(Russ. Lang.): v.10, N12, 2536-2542.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent H2SO4 sulphuric acid