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1,2-Benzenediol, o-(5-chlorovaleryl)-o-(2-methylbenzoyl)-

View entire compound with spectra: 1 NMR

1,2-Benzenediol, o-(5-chlorovaleryl)-o-(2-methylbenzoyl)-
SpectraBase Compound ID C451ZbkhfG0
InChI InChI=1S/C19H19ClO4/c1-14-8-2-3-9-15(14)19(22)24-17-11-5-4-10-16(17)23-18(21)12-6-7-13-20/h2-5,8-11H,6-7,12-13H2,1H3
InChIKey BIGGSAKOROGZJQ-UHFFFAOYSA-N
Mol Weight 346.81 g/mol
Molecular Formula C19H19ClO4
Exact Mass 346.097187 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JA11HBAaxrk
Name 1,2-Benzenediol, o-(5-chlorovaleryl)-o-(2-methylbenzoyl)-
Comments Computed using HOSE algorithm
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Exact Mass 346.097186788 u
Formula C19H19ClO4
InChI InChI=1S/C19H19ClO4/c1-14-8-2-3-9-15(14)19(22)24-17-11-5-4-10-16(17)23-18(21)12-6-7-13-20/h2-5,8-11H,6-7,12-13H2,1H3
InChIKey BIGGSAKOROGZJQ-UHFFFAOYSA-N
Molecular Weight 346.810 g/mol
SMILES C1(=CC=CC=C1OC(=O)C1=CC=CC=C1C)OC(=O)CCCCCl