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1,3-Benzenediol, o-(2-chlorobenzoyl)-o'-(5-chlorovaleryl)-

View entire compound with spectra: 1 NMR, and 1 FTIR

1,3-Benzenediol, o-(2-chlorobenzoyl)-o'-(5-chlorovaleryl)-
SpectraBase Compound ID F5KTD0HkgUA
InChI InChI=1S/C18H16Cl2O4/c19-11-4-3-10-17(21)23-13-6-5-7-14(12-13)24-18(22)15-8-1-2-9-16(15)20/h1-2,5-9,12H,3-4,10-11H2
InChIKey UGKVPEBGTVYACL-UHFFFAOYSA-N
Mol Weight 367.23 g/mol
Molecular Formula C18H16Cl2O4
Exact Mass 366.042564 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3I6LaZL7L3h
Name 1,3-Benzenediol, o-(2-chlorobenzoyl)-o'-(5-chlorovaleryl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 366.042564391 u
Formula C18H16Cl2O4
InChI InChI=1S/C18H16Cl2O4/c19-11-4-3-10-17(21)23-13-6-5-7-14(12-13)24-18(22)15-8-1-2-9-16(15)20/h1-2,5-9,12H,3-4,10-11H2
InChIKey UGKVPEBGTVYACL-UHFFFAOYSA-N
Molecular Weight 367.228 g/mol
SMILES C1=C(C=CC=C1OC(=O)CCCCCl)OC(=O)C1=C(C=CC=C1)Cl