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2-Furoic acid, pentyl ester
SpectraBase Compound ID L4QpUVdGaWJ
InChI InChI=1S/C10H14O3/c1-2-3-4-7-13-10(11)9-6-5-8-12-9/h5-6,8H,2-4,7H2,1H3
InChIKey BGJZMKPSRLHMME-UHFFFAOYSA-N
Mol Weight 182.22 g/mol
Molecular Formula C10H14O3
Exact Mass 182.094294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8ebfHONyoNg
Name Furoate
Source of Sample SAFC Cat.no. W207209
CAS Registry Number 4996-48-9
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 182.094294308 u
Formula C10H14O3
InChI InChI=1S/C10H14O3/c1-2-3-4-7-13-10(11)9-6-5-8-12-9/h5-6,8H,2-4,7H2,1H3
InChIKey BGJZMKPSRLHMME-UHFFFAOYSA-N
Molecular Weight 182.219 g/mol
Number of Peaks 50
RI1 1353
RI2 1031
RI3 1287
RI4 1243
RI5 1327
SMILES c1cc(oc1)C(OCCCCC)=O
SPLASH splash10-03dj-9600000000-4e4a1d83808cd607f941
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 Furan-2-carboxylic acid ester
Wiley ID LM_FFNSC3_20