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Ethyl[(1S,2S,3S,4R)-2,4-Diformyl-3-phenylcyclohexyl]acetate
SpectraBase Compound ID LXt5baPZOKD
InChI InChI=1S/C18H22O4/c1-2-22-17(21)10-14-8-9-15(11-19)18(16(14)12-20)13-6-4-3-5-7-13/h3-7,11-12,14-16,18H,2,8-10H2,1H3/t14-,15-,16-,18-/m0/s1
InChIKey ICJQEVMKAONWKF-OVWQWFNUSA-N
Mol Weight 302.37 g/mol
Molecular Formula C18H22O4
Exact Mass 302.151809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CX2TVO64nvw
Name Ethyl[(1S,2S,3S,4R)-2,4-Diformyl-3-phenylcyclohexyl]acetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O4
InChI InChI=1S/C18H22O4/c1-2-22-17(21)10-14-8-9-15(11-19)18(16(14)12-20)13-6-4-3-5-7-13/h3-7,11-12,14-16,18H,2,8-10H2,1H3/t14-,15-,16-,18-/m0/s1
InChIKey ICJQEVMKAONWKF-OVWQWFNUSA-N
Molecular Weight 302.370 g/mol
SMILES [C@@]1([C@]([C@](C=O)(CC[C@]1(CC(=O)OCC)[H])[H])(c1ccccc1)[H])(C=O)[H]
SPLASH splash10-014l-4920000000-5e398f820b9f42328924
Source of Spectrum F4-43-1890-3a
Wiley ID 1675693