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 |
SpectraBase Spectrum ID | 7fu395fFZm |
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Name | 3-phenyl-N-(p-tolylsulfonyl)-dl-alanine, pentachlorophenyl ester |
Conditions | Neutral |
Copyright | Copyright © 2008-2024 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 |
Sadtler IR Number | 22315 |
Sadtler UV Number | 24658N |
Solvent | Methanol |