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3-Pentanol, 1-(1,3-dithian-2-ylidene)-3-ethyl-2-methyl-
SpectraBase Compound ID JpkvT5lAi1E
InChI InChI=1S/C12H22OS2/c1-4-12(13,5-2)10(3)9-11-14-7-6-8-15-11/h9-10,13H,4-8H2,1-3H3
InChIKey YNTHBESSGVKHMQ-UHFFFAOYSA-N
Mol Weight 246.43 g/mol
Molecular Formula C12H22OS2
Exact Mass 246.111208 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Ho0jZPyYbqD
Name 3-Pentanol, 1-(1,3-dithian-2-ylidene)-3-ethyl-2-methyl-
Alternate Name(s) 1-(1,3-dithian-2-ylidene)-3-ethyl-2-methyl-3-pentanol 2-(1-Methyl-2-hydroxy-2-ethyl-butylmethylene)-1,3-dithiacyclohexane
CAS Registry Number 106501-23-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H22OS2
InChI InChI=1S/C12H22OS2/c1-4-12(13,5-2)10(3)9-11-14-7-6-8-15-11/h9-10,13H,4-8H2,1-3H3
InChIKey YNTHBESSGVKHMQ-UHFFFAOYSA-N
Molecular Weight 246.427 g/mol
SMILES OC(C(C=C1SCCCS1)C)(CC)CC
SPLASH splash10-06rj-2940000000-c5322d58deb0c16cebf4
Source of Spectrum J-52-860-7
Wiley ID 1248675