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4-Acetoxy-5-benzoyl-O-methyloxime[2.2]paracyclophane
SpectraBase Compound ID Dz8DeC7ttBP
InChI InChI=1S/C26H25NO3/c1-18(28)30-26-23-15-13-20-10-8-19(9-11-20)12-14-21(16-17-23)24(26)25(27-29-2)22-6-4-3-5-7-22/h3-11,16-17H,12-15H2,1-2H3/b27-25+
InChIKey YDOHSGHTPWBIRB-IMVLJIQESA-N
Mol Weight 399.49 g/mol
Molecular Formula C26H25NO3
Exact Mass 399.183444 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9jjpDSvE8np
Name 4-Acetoxy-5-benzoyl-O-methyloxime[2.2]paracyclophane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H25NO3
InChI InChI=1S/C26H25NO3/c1-18(28)30-26-23-15-13-20-10-8-19(9-11-20)12-14-21(16-17-23)24(26)25(27-29-2)22-6-4-3-5-7-22/h3-11,16-17H,12-15H2,1-2H3/b27-25+
InChIKey YDOHSGHTPWBIRB-IMVLJIQESA-N
Literature Reference DOI 10.1002/adsc.201200625
Molecular Weight 399.490 g/mol
SMILES c1c2ccc(CCc3ccc(CC2)c(\C(=N\OC)c2ccccc2)c3OC(C)=O)c1
SPLASH splash10-0uka-0396100000-25ebbc8ce43254afb819
Source of Spectrum ASC-354-3244-5c
Wiley ID 1762841