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1,3,5-Trifluoro-7-iodo-adamantane
SpectraBase Compound ID 47fc6qjck6p
InChI InChI=1S/C10H12F3I/c11-7-1-8(12)3-9(13,2-7)6-10(14,4-7)5-8/h1-6H2/t7-,8+,9-,10+
InChIKey SCBOIIBCAUGOOA-YNFQOJQRSA-N
Mol Weight 316.11 g/mol
Molecular Formula C10H12F3I
Exact Mass 315.99358 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CHO3ldkwRrn
Name 1,3,5-Trifluoro-7-iodo-adamantane
CAS Registry Number 109614-03-1
Comments IODINE CONNECTED TO C7 J(FC) PROBABLY TREATED AS FIRST ORDER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H12F3I
InChI InChI=1S/C10H12F3I/c11-7-1-8(12)3-9(13,2-7)6-10(14,4-7)5-8/h1-6H2/t7-,8+,9-,10+
InChIKey SCBOIIBCAUGOOA-YNFQOJQRSA-N
Literature Reference M. Bremer, P.R. Schleyer, K. Schoetz, Angew. Chem. 99, 795 (1987).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3