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6-(mesylthio)hexanoic acid
SpectraBase Compound ID EDOApnStQk2
InChI InChI=1S/C7H14O4S2/c1-13(10,11)12-6-4-2-3-5-7(8)9/h2-6H2,1H3,(H,8,9)
InChIKey FELVFSYUZJCULW-UHFFFAOYSA-N
Mol Weight 226.3 g/mol
Molecular Formula C7H14O4S2
Exact Mass 226.033351 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5NsnLpg1rgu
Name 6-(mesylthio)hexanoic acid
Alternate Name(s) 6-(methylsulfonylthio)hexanoic acid 6-Methylsulfonylsulfanylhexanoic acid
CAS Registry Number 76078-72-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14O4S2
InChI InChI=1S/C7H14O4S2/c1-13(10,11)12-6-4-2-3-5-7(8)9/h2-6H2,1H3,(H,8,9)
InChIKey FELVFSYUZJCULW-UHFFFAOYSA-N
Molecular Weight 226.305 g/mol
SMILES OC(CCCCCSS(=O)(=O)C)=O
SPLASH splash10-01ri-8900000000-2b98e4eed26ecb8557f2
Source of Spectrum W5-1989-24677-1
Wiley ID 1226737