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3-(Isopropylthio)-N-(p-tolylsulfonyl)-L-alanine

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3-(Isopropylthio)-N-(p-tolylsulfonyl)-L-alanine
SpectraBase Compound ID AAkXWwakC0X
InChI InChI=1S/C13H19NO4S2/c1-9(2)19-8-12(13(15)16)14-20(17,18)11-6-4-10(3)5-7-11/h4-7,9,12,14H,8H2,1-3H3,(H,15,16)
InChIKey RZCGWNAPXOFNPG-UHFFFAOYSA-N
Mol Weight 317.42 g/mol
Molecular Formula C13H19NO4S2
Exact Mass 317.07555 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LPyWhSGX7yC
Name 3-(ISOPROPYLTHIO)-N-(p-TOLYLSULFONYL)-L-ALANINE
Source of Sample Duquesne University, Pittsburgh, Pennsylvania
Copyright Copyright © 1980, 1981-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H19NO4S2
InChI InChI=1S/C13H19NO4S2/c1-9(2)19-8-12(13(15)16)14-20(17,18)11-6-4-10(3)5-7-11/h4-7,9,12,14H,8H2,1-3H3,(H,15,16)
InChIKey RZCGWNAPXOFNPG-UHFFFAOYSA-N
Melting Point 116.5-117C
Molecular Weight 317.417999
Synonyms ALANINE, 3-/ISOPROPYLTHIO/-N-/P- TOLYLSULFONYL/-, L-,
Technique KBr WAFER