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1-[(1-adamantyl)carbonyl]-3-[3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolyl]urea
SpectraBase Compound ID DYiYh2mQOTd
InChI InChI=1S/C22H23Cl2N3O3/c1-11-18(19(27-30-11)17-15(23)3-2-4-16(17)24)25-21(29)26-20(28)22-8-12-5-13(9-22)7-14(6-12)10-22/h2-4,12-14H,5-10H2,1H3,(H2,25,26,28,29)/t12-,13+,14-,22-
InChIKey LLUHAQVUUCYDMX-MEFDUVCQSA-N
Mol Weight 448.35 g/mol
Molecular Formula C22H23Cl2N3O3
Exact Mass 447.111647 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 6aXUA2c9L2G
Name 1-[(1-ADAMANTYL)CARBONYL]-3-[3-(2,6-DICHLOROPHENYL)-5-METHYL-4-ISOXAZOLYL]UREA
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number CD 9057
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H23Cl2N3O3
InChI InChI=1S/C22H23Cl2N3O3/c1-11-18(19(27-30-11)17-15(23)3-2-4-16(17)24)25-21(29)26-20(28)22-8-12-5-13(9-22)7-14(6-12)10-22/h2-4,12-14H,5-10H2,1H3,(H2,25,26,28,29)/t12-,13+,14-,22-
InChIKey LLUHAQVUUCYDMX-MEFDUVCQSA-N
Melting Point 280-282C
Molecular Weight 448.350000
Synonyms UREA, 1-//1-ADAMANTYL/CARBONYL/- 3-/3-/2,6-DICHLOROPHENYL/-5-METHYL- 4-ISOXAZOLYL/-,
Technique KBr WAFER