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3-ETHYL-1,1,1-TRIS-(METHYLTHIO)-HEPTANE

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3-ETHYL-1,1,1-TRIS-(METHYLTHIO)-HEPTANE
SpectraBase Compound ID 3zpM9Twd1Vp
InChI InChI=1S/C12H26S3/c1-6-8-9-11(7-2)10-12(13-3,14-4)15-5/h11H,6-10H2,1-5H3
InChIKey HYYAEFDXJKWVOG-UHFFFAOYSA-N
Mol Weight 266.52 g/mol
Molecular Formula C12H26S3
Exact Mass 266.119664 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Da494aeEtLM
Name 3-ETHYL-1,1,1-TRIS-(METHYLTHIO)-HEPTANE
Compound Number 21
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H26S3
InChI InChI=1S/C12H26S3/c1-6-8-9-11(7-2)10-12(13-3,14-4)15-5/h11H,6-10H2,1-5H3
InChIKey HYYAEFDXJKWVOG-UHFFFAOYSA-N
Literature Reference Author A.HAGOOLY,I.BEN-DAVID,S.ROZEN
Literature Reference Citation J.ORG.CHEM.,67,8430(2002)
Literature Reference DOI 10.1021/jo026128b
Molecular Weight 266.518 g/mol
Solvent CDCl3
Source File Reference UWVN23684