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mercaptoacetic acid, 2-ethylhexyl ester
SpectraBase Compound ID IbovPnmE0fx
InChI InChI=1S/C10H20O2S/c1-3-5-6-9(4-2)7-12-10(11)8-13/h9,13H,3-8H2,1-2H3
InChIKey OWHSTLLOZWTNTQ-UHFFFAOYSA-N
Mol Weight 204.33 g/mol
Molecular Formula C10H20O2S
Exact Mass 204.118401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3JNJKB70BHq
Name Acetic acid, mercapto-, 2-ethylhexyl ester
Alternate Name(s) 2-Ethylhexyl sulfanylacetate 2-Ethylhexyl mercaptoacetate 2-Ethylhexyl thioglycolate Mercaptoacetic acid 2-ethylhexyl ester Thioglycolic acid 2-ethylhexyl ester Thioglykolsaeure-2-aethylhexyl ester 2-Ethylhexyl 2-sulfanylacetate 2-Ethylhexyl 2-sulfanylethanoate
CAS Registry Number 7659-86-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H20O2S
InChI InChI=1S/C10H20O2S/c1-3-5-6-9(4-2)7-12-10(11)8-13/h9,13H,3-8H2,1-2H3
InChIKey OWHSTLLOZWTNTQ-UHFFFAOYSA-N
Molecular Weight 204.328 g/mol
SMILES SCC(OCC(CC)CCCC)=O
SPLASH splash10-0abc-9000000000-77bf6eadbabcbcc2a9ab
Source of Spectrum NP-4-3019-0
Wiley ID 1103831