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2H-1-Benzopyran-2-one, 4-hydroxy-
SpectraBase Compound ID 4j2wwJwWeMd
InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-4H,5H2
InChIKey BQLSCAPEANVCOG-UHFFFAOYSA-N
Mol Weight 162.14 g/mol
Molecular Formula C9H6O3
Exact Mass 162.031694 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eb5mM8BA74X
Name Coumarin <4-hydroxy->
CAS Registry Number 1076-38-6
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 162.031694050 u
Formula C9H6O3
InChI InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-4H,5H2
InChIKey BQLSCAPEANVCOG-UHFFFAOYSA-N
Molecular Weight 162.144 g/mol
Number of Peaks 20
RI1 1794
SMILES C1(=O)c2c(OC(C1)=O)cccc2
SPLASH splash10-006x-9400000000-b50717d78e0fd72dd5eb
Sample Comments RI1: measured on SLB-5ms (Hydro) RI2: measured on SLB-5ms (FAMEs) RI3: measured on Supelcowax-10 (FAMEs) RI4: measured on Supelcowax-10 (FAEEs) RI5: measured on Equity-1 (Hydro)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms 2H-1-Benzopyran-2-one, 4-hydroxy-
Wiley ID LM_FFNSC3_2135