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14,17-BIS-(PHENYLTHIO)-TRICYCLO-[10.3.3.0(1,12)]-OCTADECA-13,16-DIENE
SpectraBase Compound ID 8P3NgLrMgwM
InChI InChI=1S/C30H36S2/c1-2-4-6-14-20-30-23-27(31-25-15-9-7-10-16-25)21-29(30,19-13-5-3-1)22-28(24-30)32-26-17-11-8-12-18-26/h7-12,15-18,21,24H,1-6,13-14,19-20,22-23H2/t29-,30+/m1/s1
InChIKey IELLIVWPXHSMEM-IHLOFXLRSA-N
Mol Weight 460.7 g/mol
Molecular Formula C30H36S2
Exact Mass 460.225844 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5devQaWeu5v
Name 14,17-BIS-(PHENYLTHIO)-TRICYCLO-[10.3.3.0(1,12)]-OCTADECA-13,16-DIENE
CAS Registry Number 139462-77-4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H36S2
InChI InChI=1S/C30H36S2/c1-2-4-6-14-20-30-23-27(31-25-15-9-7-10-16-25)21-29(30,19-13-5-3-1)22-28(24-30)32-26-17-11-8-12-18-26/h7-12,15-18,21,24H,1-6,13-14,19-20,22-23H2/t29-,30+/m1/s1
InChIKey IELLIVWPXHSMEM-IHLOFXLRSA-N
Literature Reference Author H.QUAST,J.CARLSEN,R.JANIAK,E.M.PETERS,K.PETERS,H.G.VONSCHNER ING
Literature Reference Citation CHEM.BER.,125,955(1992)
Literature Reference DOI 10.1002/cber.19921250430
Molecular Weight 460.736 g/mol
Solvent CDCl3
Source File Reference UWCS8658