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6-bromo-3-butyl-7-hydroxy-8-(2-mercaptopropionyl)-4-methyl-coumarin-8-(4-morpholinecarbodithioate)
SpectraBase Compound ID 2xvZt1IXibj
InChI InChI=1S/C22H26BrNO5S2/c1-4-5-6-14-12(2)15-11-16(23)19(26)17(20(15)29-21(14)27)18(25)13(3)31-22(30)24-7-9-28-10-8-24/h11,13,26H,4-10H2,1-3H3
InChIKey MVECTMVWBXRCIW-UHFFFAOYSA-N
Mol Weight 528.48 g/mol
Molecular Formula C22H26BrNO5S2
Exact Mass 527.043578 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9bcE1aklOC8
Name 6-BROMO-3-BUTYL-7-HYDROXY-8-(2-MERCAPTOPROPIONYL)-4-METHYLCOUMARIN, 8-(4-MORPHOLINECARBODITHIOATE)
Source of Sample A. CASCAVAL, POLYTECHNIC INSTITUTE OF IASSY, IASI, ROMANIA
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H26BrNO5S2
InChI InChI=1S/C22H26BrNO5S2/c1-4-5-6-14-12(2)15-11-16(23)19(26)17(20(15)29-21(14)27)18(25)13(3)31-22(30)24-7-9-28-10-8-24/h11,13,26H,4-10H2,1-3H3
InChIKey MVECTMVWBXRCIW-UHFFFAOYSA-N
Melting Point 199-200C
Molecular Weight 528.481995
Synonyms COUMARIN, 6-BROMO-3-BUTYL- 7-HYDROXY-8-/2-MERCAPTOPROPIONYL/- 4-METHYL-, 8-/4-MORPHOLINECARBODI- THIOATE/
Technique KBr WAFER