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2,2,5-TRIFLUORINDAN

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2,2,5-TRIFLUORINDAN
SpectraBase Compound ID 1AMllYlqKhI
InChI InChI=1S/C9H7F3/c10-8-2-1-6-4-9(11,12)5-7(6)3-8/h1-3H,4-5H2
InChIKey DZHFQKHOKGZMIX-UHFFFAOYSA-N
Mol Weight 172.15 g/mol
Molecular Formula C9H7F3
Exact Mass 172.049985 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fe4z4d5V1pV
Name 2,2,5-Trifluoro-indan
CAS Registry Number 57584-73-3
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H7F3
InChI InChI=1S/C9H7F3/c10-8-2-1-6-4-9(11,12)5-7(6)3-8/h1-3H,4-5H2
InChIKey DZHFQKHOKGZMIX-UHFFFAOYSA-N
Instrument Name Bruker WH-90
Literature Reference W. Adcock, B.D. Gupta, W. Kitching, J. Org. Chem. 41, 1498 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3