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3,6,9-Trioxatetracyclo(6.1.0.0(sup 2,4).0(sup 5,7))nonane, anti-

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3,6,9-Trioxatetracyclo(6.1.0.0(sup 2,4).0(sup 5,7))nonane, anti-
SpectraBase Compound ID 88T4yjNRDVG
InChI InChI=1S/C6H6O3/c7-1-2(7)4-6(9-4)5-3(1)8-5/h1-6H
InChIKey UDUYERSGOVZJPD-UHFFFAOYSA-N
Mol Weight 126.11 g/mol
Molecular Formula C6H6O3
Exact Mass 126.031694 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LQkCYNo4Mjw
Name (1a,2a,4a,5a,7a,8A)-3,6,9-Trioxa-tetracyclo(6.1.0.0.0)nonane
CAS Registry Number 39078-11-0
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C6H6O3
InChI InChI=1S/C6H6O3/c7-1-2(7)4-6(9-4)5-3(1)8-5/h1-6H
InChIKey UDUYERSGOVZJPD-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Literature Reference R. Schwesinger, H. Fritz, H. Prinzbach, Chem. Ber. 112, 3318 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD3CN