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3-(alpha-ACETONYLBENZYL)-4-HYDROXY-1-THIOCOUMARIN
SpectraBase Compound ID EDW7zhGoSFY
InChI InChI=1S/C19H16O3S/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3
InChIKey KRMBKNSOMHWYFC-UHFFFAOYSA-N
Mol Weight 324.39 g/mol
Molecular Formula C19H16O3S
Exact Mass 324.082016 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 9ibJ3hrYeX1
Name 3-(alpha-ACETONYLBENZYL)-4-HYDROXY-1-THIOCOUMARIN
Source of Sample S. Rajagopal, Karnatak University, Dharwar, India
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H16O3S
InChI InChI=1S/C19H16O3S/c1-12(20)11-15(13-7-3-2-4-8-13)17-18(21)14-9-5-6-10-16(14)23-19(17)22/h2-10,15,21H,11H2,1H3
InChIKey KRMBKNSOMHWYFC-UHFFFAOYSA-N
Melting Point 162C
Molecular Weight 324.394012
Synonyms 1-THIOCOUMARIN, 4-HYDROXY-3-/3-OXO- 1-PHENYLBUTYL/-, 1-THIOCOUMARIN, 3-/A-ACETONYLBENZYL/- 4-HYDROXY-,
Technique KBr WAFER