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Benzoin
SpectraBase Compound ID 50U6Nqs232E
InChI InChI=1S/C14H12O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13,15H
InChIKey ISAOCJYIOMOJEB-UHFFFAOYSA-N
Mol Weight 212.25 g/mol
Molecular Formula C14H12O2
Exact Mass 212.08373 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 56b31ZqZme0
Name Benzoin
Source of Sample SAFC Cat.no. W213306
CAS Registry Number 579-44-2
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 212.083729624 u
Formula C14H12O2
InChI InChI=1S/C14H12O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13,15H
InChIKey ISAOCJYIOMOJEB-UHFFFAOYSA-N
Molecular Weight 212.248 g/mol
Number of Peaks 22
RI1 1805
RI2 1482
SMILES OC(C(=O)c1ccccc1)c1ccccc1
SPLASH splash10-0a6r-8900000000-f064afdb81e6939624a6
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 Ethanone, 2-hydroxy-1,2-diphenyl-
Wiley ID LM_FFNSC3_287