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3-(alpha-ACETONYLBENZYL)-6-BROMO-4-HYDROXY-1-THIOCOUMARIN
SpectraBase Compound ID I2YSZZ6OrIv
InChI InChI=1S/C19H15BrO3S/c1-11(21)9-14(12-5-3-2-4-6-12)17-18(22)15-10-13(20)7-8-16(15)24-19(17)23/h2-8,10,14,22H,9H2,1H3
InChIKey DXACLJKYHJIBBP-UHFFFAOYSA-N
Mol Weight 403.29 g/mol
Molecular Formula C19H15BrO3S
Exact Mass 401.992529 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID Kyp8PMAFFjR
Name 3-(alpha-ACETONYLBENZYL)-6-BROMO-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 C19H15BrO3S
InChI InChI=1S/C19H15BrO3S/c1-11(21)9-14(12-5-3-2-4-6-12)17-18(22)15-10-13(20)7-8-16(15)24-19(17)23/h2-8,10,14,22H,9H2,1H3
InChIKey DXACLJKYHJIBBP-UHFFFAOYSA-N
Melting Point 176C
Molecular Weight 403.295990
Synonyms 1-THIOCOUMARIN, 6-BROMO-4-HYDROXY- 3-/3-OXO-1-PHENYLBUTYL/-, 1-THIOCOUMARIN, 3-/A-ACETONYLBENZYL/- 6-BROMO-4-HYDROXY-,
Technique KBr WAFER