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Acetic acid isopropyl ester
SpectraBase Compound ID VaBlAjN89q
InChI InChI=1S/C5H10O2/c1-4(2)7-5(3)6/h4H,1-3H3
InChIKey JMMWKPVZQRWMSS-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 8FmIvAp53gh
Name Acetate
Source of Sample SAFC Cat. #W292605
CAS Registry Number 108-21-4
Classification Solvents
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/c1-4(2)7-5(3)6/h4H,1-3H3
InChIKey JMMWKPVZQRWMSS-UHFFFAOYSA-N
Molecular Weight 102.133 g/mol
Number of Peaks 27
RI1 650
SMILES CC(OC(C)=O)C
SPLASH splash10-0006-9000000000-a3497b878515b37b4f8c
Sample Comments RI1: measured on SLB-5ms (Alkanes) RI2: measured on Equity-1 (Alkanes)
Source of Spectrum Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy)
Synonyms Acetic acid, 1-methylethyl ester
Wiley ID LM_PEST_1230