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3-phenyl-N-(p-tolylsulfonyl)-D,L-alanine, pentachlorophenyl ester

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 UV-Vis

3-phenyl-N-(p-tolylsulfonyl)-D,L-alanine, pentachlorophenyl ester
SpectraBase Compound ID FHDsDnzXVAU
InChI InChI=1S/C22H16Cl5NO4S/c1-12-7-9-14(10-8-12)33(30,31)28-15(11-13-5-3-2-4-6-13)22(29)32-21-19(26)17(24)16(23)18(25)20(21)27/h2-10,15,28H,11H2,1H3
InChIKey TVWUPOKUWHIUHU-UHFFFAOYSA-N
Mol Weight 567.7 g/mol
Molecular Formula C22H16Cl5NO4S
Exact Mass 564.924268 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 543OsjU64bB
Name 3-PHENYL-N-(p-TOLYLSULFONYL)-DL-ALANINE, PENTACHLOROPHENYL ESTER
Source of Sample G. Kupryszewski, Wyzsza Szkola Pedagogiczna, Gdansk, Poland
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H16Cl5NO4S
InChI InChI=1S/C22H16Cl5NO4S/c1-12-7-9-14(10-8-12)33(30,31)28-15(11-13-5-3-2-4-6-13)22(29)32-21-19(26)17(24)16(23)18(25)20(21)27/h2-10,15,28H,11H2,1H3
InChIKey TVWUPOKUWHIUHU-UHFFFAOYSA-N
Melting Point 202-203C
Molecular Weight 567.682983
Synonyms ALANINE, 3-PHENYL-N-/P-TOLYL- SULFONYL/-, DL-, PENTACHLOROPHENYL ESTER
Technique KBr WAFER