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5-EXO-HYDROXYTRICYCLO[2.2.1.0(2,6)]HEPTAN-3-ONE, ETHYLSULPHATE
SpectraBase Compound ID 8M1I2EgfEoL
InChI InChI=1S/C9H12O5S/c1-2-13-15(11,12)14-9-5-3-4-6(7(4)9)8(5)10/h4-7,9H,2-3H2,1H3
InChIKey QCTXMEYPFNTSEF-UHFFFAOYSA-N
Mol Weight 232.25 g/mol
Molecular Formula C9H12O5S
Exact Mass 232.040545 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 94F4y0hLlbt
Name 5-EXO-HYDROXYTRICYCLO[2.2.1.0(2,6)]HEPTAN-3-ONE, ETHYLSULPHATE
Comments C
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H12O5S
InChI InChI=1S/C9H12O5S/c1-2-13-15(11,12)14-9-5-3-4-6(7(4)9)8(5)10/h4-7,9H,2-3H2,1H3
InChIKey QCTXMEYPFNTSEF-UHFFFAOYSA-N
Instrument Name Bruker AC-200
Literature Reference N.S.ZEFIROV, YU.A.LAPIN, E.E.NESTEROV, N.V.ZYK (1993) Zhurn.Org.Khim.(Russ.Lang.): v.29, N7, 1489-1490.
NMR Standard not reported
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d