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2-butyne-1,4-diol, bis(3,4-dichlorocarbanilate)

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

2-butyne-1,4-diol, bis(3,4-dichlorocarbanilate)
SpectraBase Compound ID Cs3gVX1sqJg
InChI InChI=1S/C18H12Cl4N2O4/c19-13-5-3-11(9-15(13)21)23-17(25)27-7-1-2-8-28-18(26)24-12-4-6-14(20)16(22)10-12/h3-6,9-10H,7-8H2,(H,23,25)(H,24,26)
InChIKey ISOMQUBPJBCDST-UHFFFAOYSA-N
Mol Weight 462.1 g/mol
Molecular Formula C18H12Cl4N2O4
Exact Mass 459.955118 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 4l3itAOQ9SP
Name 2-BUTYNE-1,4-DIOL, BIS(3,4-DICHLOROCARBANILATE)
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Catalog Number S39930
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12Cl4N2O4
InChI InChI=1S/C18H12Cl4N2O4/c19-13-5-3-11(9-15(13)21)23-17(25)27-7-1-2-8-28-18(26)24-12-4-6-14(20)16(22)10-12/h3-6,9-10H,7-8H2,(H,23,25)(H,24,26)
InChIKey ISOMQUBPJBCDST-UHFFFAOYSA-N
Molecular Weight 462.104004
Synonyms 2-BUTYNE-1,4-DIOL, BIS/3,4-DICHLORO- CARBANILATE/
Technique KBr WAFER