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Oxybenzone
SpectraBase Compound ID IyeFcq5trKW
InChI InChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3
InChIKey DXGLGDHPHMLXJC-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C14H12O3
Exact Mass 228.078644 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9UzMYfDbclu
Name Benzophenone <2-hydroxy-, 4-methoxy->
CAS Registry Number 131-57-7
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 228.078644243 u
Formula C14H12O3
InChI InChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3
InChIKey DXGLGDHPHMLXJC-UHFFFAOYSA-N
Molecular Weight 228.247 g/mol
Number of Peaks 50
RI1 1433
RI2 1112
SMILES Oc1c(ccc(c1)OC)C(=O)c1ccccc1
SPLASH splash10-0fb9-4790000000-27ecb5061708dae013f8
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 Methanone, (2-hydroxy-4-methoxyphenyl)phenyl-
Wiley ID LM_FFNSC3_1826