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3,3-BIS(HYDROXYMETHYL)-2,3-DIHYDRO-4H-1-BENZOPYRAN-4-ONE, BIS(2,4-DICHLOROBENZOATE)

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

3,3-BIS(HYDROXYMETHYL)-2,3-DIHYDRO-4H-1-BENZOPYRAN-4-ONE, BIS(2,4-DICHLOROBENZOATE)
SpectraBase Compound ID 3CzrZZjbJlh
InChI InChI=1S/C25H16Cl4O6/c26-14-5-7-16(19(28)9-14)23(31)34-12-25(11-33-21-4-2-1-3-18(21)22(25)30)13-35-24(32)17-8-6-15(27)10-20(17)29/h1-10H,11-13H2
InChIKey LQVSMVDZZZIDGZ-UHFFFAOYSA-N
Mol Weight 554.2 g/mol
Molecular Formula C25H16Cl4O6
Exact Mass 551.970099 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 5S65DwYiz21
Name 3,3-BIS(HYDROXYMETHYL)-2,3-DIHYDRO-4H-1-BENZOPYRAN-4-ONE, BIS(2,4-DICHLOROBENZOATE)
Source of Sample BIONET RESEARCH LTD., CORNWALL, ENGLAND
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H16Cl4O6
InChI InChI=1S/C25H16Cl4O6/c26-14-5-7-16(19(28)9-14)23(31)34-12-25(11-33-21-4-2-1-3-18(21)22(25)30)13-35-24(32)17-8-6-15(27)10-20(17)29/h1-10H,11-13H2
InChIKey LQVSMVDZZZIDGZ-UHFFFAOYSA-N
Melting Point 119-121C
Molecular Weight 554.21
Technique KBr WAFER