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3-(alpha-hydroxybenzyl)coumarin, butyrate
SpectraBase Compound ID GliiUnGPaJB
InChI InChI=1S/C20H18O4/c1-2-8-18(21)24-19(14-9-4-3-5-10-14)16-13-15-11-6-7-12-17(15)23-20(16)22/h3-7,9-13,19H,2,8H2,1H3
InChIKey YCPSTXCGYDNQBX-UHFFFAOYSA-N
Mol Weight 322.36 g/mol
Molecular Formula C20H18O4
Exact Mass 322.120509 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 1sGX2mZb5Iz
Name 3-(alpha-HYDROXYBENZYL)COUMARIN, BUTYRATE
Source of Sample A. Bojilova and C. Ivanov, University of Sofia, Sofia, Bulgaria
Comments Tentative assignment
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H18O4
InChI InChI=1S/C20H18O4/c1-2-8-18(21)24-19(14-9-4-3-5-10-14)16-13-15-11-6-7-12-17(15)23-20(16)22/h3-7,9-13,19H,2,8H2,1H3
InChIKey YCPSTXCGYDNQBX-UHFFFAOYSA-N
Melting Point 72-74C
Molecular Weight 322.37
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms COUMARIN, 3-/A-HYDROXYBENZYL/-, BUTYRATE