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6-Chloro-1-(4-methoxyphenyl)hexane-1,2-dione

View entire compound with spectra: 1 MS (GC)

6-Chloro-1-(4-methoxyphenyl)hexane-1,2-dione
SpectraBase Compound ID 6IuJybDtyXQ
InChI InChI=1S/C13H15ClO3/c1-17-11-7-5-10(6-8-11)13(16)12(15)4-2-3-9-14/h5-8H,2-4,9H2,1H3
InChIKey CFSUVJGTNKAQJW-UHFFFAOYSA-N
Mol Weight 254.71 g/mol
Molecular Formula C13H15ClO3
Exact Mass 254.070972 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6BanJMcyxZg
Name 6-Chloro-1-(4-methoxyphenyl)hexane-1,2-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15ClO3
InChI InChI=1S/C13H15ClO3/c1-17-11-7-5-10(6-8-11)13(16)12(15)4-2-3-9-14/h5-8H,2-4,9H2,1H3
InChIKey CFSUVJGTNKAQJW-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c5ra03772g
Molecular Weight 254.713 g/mol
SMILES C(CCC(C(=O)c1ccc(cc1)OC)=O)CCl
SPLASH splash10-000i-4900000000-935c087e991357d1dce2
Source of Spectrum RSA-5-36652/SM-5fc
Wiley ID 1761415