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3-(2,4-difluorophenyl)-1-heptyl-1-(p-neopentylbenzyl)urea
SpectraBase Compound ID JpE9LQzve3n
InChI InChI=1S/C26H36F2N2O/c1-5-6-7-8-9-16-30(25(31)29-24-15-14-22(27)17-23(24)28)19-21-12-10-20(11-13-21)18-26(2,3)4/h10-15,17H,5-9,16,18-19H2,1-4H3,(H,29,31)
InChIKey QKJLDOBXDUVGEE-UHFFFAOYSA-N
Mol Weight 430.6 g/mol
Molecular Formula C26H36F2N2O
Exact Mass 430.27957 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 86Qrxh5xRYO
Name 3-(2,4-DIFLUOROPHENYL)-1-HEPTYL-1-(p-NEOPENTYLBENZYL)UREA
Source of Sample D. K. McCLINTOCK, AMERICAN CYANAMID COMPANY, PEARL RIVER, NEW YORK
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36F2N2O
InChI InChI=1S/C26H36F2N2O/c1-5-6-7-8-9-16-30(25(31)29-24-15-14-22(27)17-23(24)28)19-21-12-10-20(11-13-21)18-26(2,3)4/h10-15,17H,5-9,16,18-19H2,1-4H3,(H,29,31)
InChIKey QKJLDOBXDUVGEE-UHFFFAOYSA-N
Literature Reference J. MED. CHEM. 29, 1131(1986) Abstract-Chemical Abstracts= 105, 18199T(1986)
Molecular Weight 430.587006
Synonyms UREA, 3-/2,4-DIFLUOROPHENYL/- 1-HEPTYL-1-/P-NEOPENTYLBENZYL/-,
Technique KBr WAFER