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(2E,4S,5R)-4-Allyloxy-5,6-cyclohexylidenedioxyhex-2-enyl-1,1-diacetate

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(2E,4S,5R)-4-Allyloxy-5,6-cyclohexylidenedioxyhex-2-enyl-1,1-diacetate
SpectraBase Compound ID JJErmscPFd1
InChI InChI=1S/C19H28O7/c1-4-12-22-16(8-9-18(24-14(2)20)25-15(3)21)17-13-23-19(26-17)10-6-5-7-11-19/h4,8-9,16-18H,1,5-7,10-13H2,2-3H3/b9-8+/t16-,17+/m0/s1
InChIKey SIXJCOWQNBEYNQ-IBHATUTGSA-N
Mol Weight 368.43 g/mol
Molecular Formula C19H28O7
Exact Mass 368.183503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FBI18VLjt9n
Name (2E,4S,5R)-4-Allyloxy-5,6-cyclohexylidenedioxyhex-2-enyl-1,1-diacetate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.183503235 u
Formula C19H28O7
InChI InChI=1S/C19H28O7/c1-4-12-22-16(8-9-18(24-14(2)20)25-15(3)21)17-13-23-19(26-17)10-6-5-7-11-19/h4,8-9,16-18H,1,5-7,10-13H2,2-3H3/b9-8+/t16-,17+/m0/s1
InChIKey SIXJCOWQNBEYNQ-IBHATUTGSA-N
Molecular Weight 368.426 g/mol
SMILES C12(O[C@](CO2)([C@](\C=C\C(OC(=O)C)OC(=O)C)(OCC=C)[H])[H])CCCCC1