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5-Chloro-2-methoxy-3,7-bis(methoxymethyl)cyclohepta-2,4,6-trien-1-one
SpectraBase Compound ID Spd7O6SQb0
InChI InChI=1S/C12H15ClO4/c1-15-6-8-4-10(13)5-9(7-16-2)12(17-3)11(8)14/h4-5H,6-7H2,1-3H3
InChIKey MYSZZVLKJNMEPM-UHFFFAOYSA-N
Mol Weight 258.7 g/mol
Molecular Formula C12H15ClO4
Exact Mass 258.065887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7FUBdWBq678
Name 5-Chloro-2-methoxy-3,7-bis(methoxymethyl)cyclohepta-2,4,6-trien-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15ClO4
InChI InChI=1S/C12H15ClO4/c1-15-6-8-4-10(13)5-9(7-16-2)12(17-3)11(8)14/h4-5H,6-7H2,1-3H3
InChIKey MYSZZVLKJNMEPM-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 258.701 g/mol
SMILES COCC1=CC(=CC(=C(C1=O)OC)COC)Cl
SPLASH splash10-002b-3930000000-9ecab15eabaf1ebb291a
Source of Spectrum SRH-2022-770-0
Wiley ID 1823247