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Acetic acid, mercapto-, sec-butyl ester
SpectraBase Compound ID 89uIW6X13QK
InChI InChI=1S/C6H12O2S/c1-3-5(2)8-6(7)4-9/h5,9H,3-4H2,1-2H3
InChIKey SHCXYFWPWOFPFI-UHFFFAOYSA-N
Mol Weight 148.22 g/mol
Molecular Formula C6H12O2S
Exact Mass 148.055801 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID E2mrbnE4o2v
Name Acetic acid, mercapto-, sec-butyl ester
CAS Registry Number 16849-96-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C6H12O2S
InChI InChI=1S/C6H12O2S/c1-3-5(2)8-6(7)4-9/h5,9H,3-4H2,1-2H3
InChIKey SHCXYFWPWOFPFI-UHFFFAOYSA-N
Molecular Weight 148.220 g/mol
SMILES SCC(=O)OC(CC)C
SPLASH splash10-0a6r-9000000000-ae7c448d6c54bd98c4d7
Source of Spectrum JX-2015-6-3083
Synonyms Sec-butyl sulfanylacetate 2-Mercaptoacetic acid butan-2-yl ester 2-Mercaptoacetic acid sec-butyl ester Butan-2-yl 2-sulfanylacetate Butan-2-yl 2-sulfanylethanoate Sec-butyl 2-sulfanylacetate sec-butyl mercapto-acetate Sec-butyl 2-mercaptoacetate
Wiley ID 1728472