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3-(ADAMANT-1-YL)-1,1,1-TRIS-(METHYLTHIO)-PROPANE

View entire compound with spectra: 1 NMR

3-(ADAMANT-1-YL)-1,1,1-TRIS-(METHYLTHIO)-PROPANE
SpectraBase Compound ID 85Cf4xQqplW
InChI InChI=1S/C16H28S3/c1-17-16(18-2,19-3)5-4-15-9-12-6-13(10-15)8-14(7-12)11-15/h12-14H,4-11H2,1-3H3/t12-,13+,14-,15+
InChIKey SIQZAUKEKVSCSZ-NMWPEEMBSA-N
Mol Weight 316.58 g/mol
Molecular Formula C16H28S3
Exact Mass 316.135314 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Gel1jKCBb8X
Name 3-(ADAMANT-1-YL)-1,1,1-TRIS-(METHYLTHIO)-PROPANE
Compound Number 31
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28S3
InChI InChI=1S/C16H28S3/c1-17-16(18-2,19-3)5-4-15-9-12-6-13(10-15)8-14(7-12)11-15/h12-14H,4-11H2,1-3H3/t12-,13+,14-,15+
InChIKey SIQZAUKEKVSCSZ-NMWPEEMBSA-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 316.578 g/mol
Solvent CDCl3
Source File Reference UWVN23693