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3-(benzylthio)-2-cyano-N-(3,4-dimethoxyphenethyl)-3-mercaptoacrylamide
SpectraBase Compound ID 5HMJBY70kET
InChI InChI=1S/C21H22N2O3S2/c1-25-18-9-8-15(12-19(18)26-2)10-11-23-20(24)17(13-22)21(27)28-14-16-6-4-3-5-7-16/h3-9,12,27H,10-11,14H2,1-2H3,(H,23,24)
InChIKey KHLUOAPQXJWCLG-UHFFFAOYSA-N
Mol Weight 414.54 g/mol
Molecular Formula C21H22N2O3S2
Exact Mass 414.107185 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Hgqtl9refkZ
Name 3-(BENZYLTHIO)-2-CYANO-N-(3,4-DIMETHOXYPHENETHYL)-3-MERCAPTOACRYLAMIDE
Source of Sample MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number CD 1386
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H22N2O3S2
InChI InChI=1S/C21H22N2O3S2/c1-25-18-9-8-15(12-19(18)26-2)10-11-23-20(24)17(13-22)21(27)28-14-16-6-4-3-5-7-16/h3-9,12,27H,10-11,14H2,1-2H3,(H,23,24)
InChIKey KHLUOAPQXJWCLG-UHFFFAOYSA-N
Melting Point 164-166C
Molecular Weight 414.537994
Synonyms ACRYLAMIDE, 3-/BENZYLTHIO/-2-CYANO- N-/3,4-DIMETHOXYPHENETHYL/-3-MERCAPTO-
Technique KBr WAFER