2-[(6,6-dimethylnorpinan-2-yl)methylthio]acetic acid methyl ester

SpectraBase Compound ID	4ICSwSJx1cy
InChI	InChI=1S/C13H22O2S/c1-13(2)10-5-4-9(11(13)6-10)7-16-8-12(14)15-3/h9-11H,4-8H2,1-3H3
InChIKey	QXQDCWRTCGVRAF-UHFFFAOYSA-N Google Search
Mol Weight	242.38 g/mol
Molecular Formula	C13H22O2S
Exact Mass	242.134051 g/mol

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SpectraBase Spectrum ID	GRvkp1B7gop
Name	2-[(6,6-dimethyl-4-bicyclo[3.1.1]heptanyl)methylthio]acetic acid methyl ester
Alternate Name(s)	2-[(6,6-dimethylnorpinan-2-yl)methylthio]acetic acid methyl ester Methyl 2-[(6,6-dimethyl-4-bicyclo[3.1.1]heptanyl)methylsulfanyl]acetate Methyl 2-[(6,6-dimethyl-4-bicyclo[3.1.1]heptanyl)methylsulfanyl]ethanoate Methyl 2-[(6,6-dimethylnorpinan-2-yl)methylsulfanyl]acetate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H22O2S
InChI	InChI=1S/C13H22O2S/c1-13(2)10-5-4-9(11(13)6-10)7-16-8-12(14)15-3/h9-11H,4-8H2,1-3H3
InChIKey	QXQDCWRTCGVRAF-UHFFFAOYSA-N
Molecular Weight	242.377 g/mol
SMILES	C1(C2C(CSCC(=O)OC)CCC1C2)(C)C
SPLASH	splash10-014l-9300000000-7c53d453c52a55bbb187
Source of Spectrum	KC-0-2133-2
Wiley ID	830841