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2-(butylthio)propanoic acid butyl ester
SpectraBase Compound ID EPqN0eaZ0Vo
InChI InChI=1S/C11H22O2S/c1-4-6-8-13-11(12)10(3)14-9-7-5-2/h10H,4-9H2,1-3H3
InChIKey MDFBTVVZESREEM-UHFFFAOYSA-N
Mol Weight 218.35 g/mol
Molecular Formula C11H22O2S
Exact Mass 218.134051 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G06fMKqob6s
Name 2-(butylthio)propanoic acid butyl ester
Alternate Name(s) 2-(butylthio)propionic acid butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H22O2S
InChI InChI=1S/C11H22O2S/c1-4-6-8-13-11(12)10(3)14-9-7-5-2/h10H,4-9H2,1-3H3
InChIKey MDFBTVVZESREEM-UHFFFAOYSA-N
Molecular Weight 218.355 g/mol
SMILES C(C(C)SCCCC)(=O)OCCCC
SPLASH splash10-05fu-9100000000-3218c2a49c81e954b20a
Source of Spectrum KD-16-2588-9
Wiley ID 1637902