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Methanesulfonic acid, pentyl ester
SpectraBase Compound ID Ke0odBkzLz3
InChI InChI=1S/C6H14O3S/c1-3-4-5-6-9-10(2,7)8/h3-6H2,1-2H3
InChIKey GZQUFIUZBLOTMM-UHFFFAOYSA-N
Mol Weight 166.23 g/mol
Molecular Formula C6H14O3S
Exact Mass 166.066365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Izsg4b9sbHb
Name Pentyl methanesulfonate
CAS Registry Number 6968-20-3
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 166.066365482 u
Formula C6H14O3S
InChI InChI=1S/C6H14O3S/c1-3-4-5-6-9-10(2,7)8/h3-6H2,1-2H3
InChIKey GZQUFIUZBLOTMM-UHFFFAOYSA-N
Molecular Weight 166.235 g/mol
Number of Peaks 50
RI1 1195
RI2 873
RI3 1346
RI4 1305
SMILES CCCCCOS(C)(=O)=O
SPLASH splash10-0596-9000000000-2c369ac958d71a7b59ee
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 Methanesulfonic acid, pentyl ester
Wiley ID LM_FFNSC3_2993