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2-[(5-Oxocyclohepta-1,3,6-trien-1-yl)oxy]ethyl-3-chlorobenzenecarboperoxoate
SpectraBase Compound ID FNK8PQWusyM
InChI InChI=1S/C16H13ClO5/c17-13-4-1-3-12(11-13)16(19)22-21-10-9-20-15-6-2-5-14(18)7-8-15/h1-8,11H,9-10H2
InChIKey DKRTZFCYLNSGED-UHFFFAOYSA-N
Mol Weight 320.73 g/mol
Molecular Formula C16H13ClO5
Exact Mass 320.045151 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2hISuqLllUH
Name 2-[(5-Oxocyclohepta-1,3,6-trien-1-yl)oxy]ethyl-3-chlorobenzenecarboperoxoate
Alternate Name(s) 2-[(5-oxo-1,3,6-cycloheptatrien-1-yl)oxy]ethyl 3-chlorobenzenecarboperoxoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H13ClO5
InChI InChI=1S/C16H13ClO5/c17-13-4-1-3-12(11-13)16(19)22-21-10-9-20-15-6-2-5-14(18)7-8-15/h1-8,11H,9-10H2
InChIKey DKRTZFCYLNSGED-UHFFFAOYSA-N
Molecular Weight 320.728 g/mol
SMILES C(c1cc(Cl)ccc1)(=O)OOCCOC=1C=CC(=O)C=CC1
SPLASH splash10-0019-1900000000-24289700d4731fe32499
Source of Spectrum F-62-4007-27
Wiley ID 1633017