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isothiocyanic acid, 2-(p-methoxyphenyl)-6-methyl-4-oxo-4H-1-benzopyran-3-yl ester
SpectraBase Compound ID GApi6etytZt
InChI InChI=1S/C18H13NO3S/c1-11-3-8-15-14(9-11)17(20)16(19-10-23)18(22-15)12-4-6-13(21-2)7-5-12/h3-9H,1-2H3
InChIKey KGHXBGPZRZPQJI-UHFFFAOYSA-N
Mol Weight 323.37 g/mol
Molecular Formula C18H13NO3S
Exact Mass 323.061614 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID CcLzve8Gwjb
Name ISOTHIOCYANIC ACID, 2-(p-METHOXYPHENYL)-6-METHYL-4-OXO-4H-1-BENZOPYRAN-3-YL ESTER
Source of Sample B. L. Verma, University of Udaipur, Udaipur, India
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H13NO3S
InChI InChI=1S/C18H13NO3S/c1-11-3-8-15-14(9-11)17(20)16(19-10-23)18(22-15)12-4-6-13(21-2)7-5-12/h3-9H,1-2H3
InChIKey KGHXBGPZRZPQJI-UHFFFAOYSA-N
Melting Point 184C
Molecular Weight 323.365997
Synonyms FLAVONE, 3-ISOTHIOCYANATO- 4*-METHOXY-6-METHYL-, ISOTHIOCYANIC ACID, 2-/P-METHOXY- PHENYL/-6-METHYL-4-OXO-4H-1-BENZOPYRAN- 3-YL ESTER
Technique KBr WAFER