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(1AR*,6AS*)-(+/-)-1A,6A-DIHYDRO-4,6A-HEPTANOOXIRENO-[B]-OXEPIN-5,6-DICARBOXYLIC-ACID-DIMETHYLESTER
SpectraBase Compound ID E2jv30cjPUK
InChI InChI=1S/C17H22O6/c1-20-14(18)12-11-8-6-4-3-5-7-9-17(13(12)15(19)21-2)16(23-17)22-10-11/h10,16H,3-9H2,1-2H3/t16-,17-/m1/s1
InChIKey JSEKVSXKOFBBGV-IAGOWNOFSA-N
Mol Weight 322.36 g/mol
Molecular Formula C17H22O6
Exact Mass 322.141638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3HEZn5jR1qa
Name (1AR*,6AS*)-(+/-)-1A,6A-DIHYDRO-4,6A-HEPTANOOXIRENO-[B]-OXEPIN-5,6-DICARBOXYLIC-ACID-DIMETHYLESTER
CAS Registry Number 140388-80-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H22O6
InChI InChI=1S/C17H22O6/c1-20-14(18)12-11-8-6-4-3-5-7-9-17(13(12)15(19)21-2)16(23-17)22-10-11/h10,16H,3-9H2,1-2H3/t16-,17-/m1/s1
InChIKey JSEKVSXKOFBBGV-IAGOWNOFSA-N
Literature Reference Author W.TOCHTERMANN,K.LUTTMANN,N.SDUNNUS,E.M.PETERS,K.PETERS,H.G.V ONSCHNERING
Literature Reference Citation CHEM.BER.,125,1485(1992)
Literature Reference DOI 10.1002/cber.19921250626
Molecular Weight 322.358 g/mol
Solvent CDCl3
Source File Reference UWCS7219