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Isobutyl formate
SpectraBase Compound ID KOedxeklJIO
InChI InChI=1S/C5H10O2/c1-5(2)3-7-4-6/h4-5H,3H2,1-2H3
InChIKey AVMSWPWPYJVYKY-UHFFFAOYSA-N
Mol Weight 102.13 g/mol
Molecular Formula C5H10O2
Exact Mass 102.06808 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CIBXW4q8wIY
Name Formate
Source of Sample SAFC Cat.no. W219703
CAS Registry Number 542-55-2
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 102.068079560 u
Formula C5H10O2
InChI InChI=1S/C5H10O2/c1-5(2)3-7-4-6/h4-5H,3H2,1-2H3
InChIKey AVMSWPWPYJVYKY-UHFFFAOYSA-N
Molecular Weight 102.133 g/mol
Number of Peaks 35
RI1 687
RI3 390
RI4 361
SMILES C(OCC(C)C)=O
SPLASH splash10-0006-9000000000-ed256b036dfe872ee6c7
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 Formic acid, 2-methylpropyl ester
Wiley ID LM_FFNSC3_428