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Ethyl 7-phenylnorcaradiene-7-carboxylate
SpectraBase Compound ID Ca5lnrGdz6e
InChI InChI=1S/C16H16O2/c1-2-18-15(17)16(12-8-4-3-5-9-12)13-10-6-7-11-14(13)16/h3-11,13-14H,2H2,1H3
InChIKey SZHMIFJETAFZRP-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C16H16O2
Exact Mass 240.11503 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FF8E6OlvQmr
Name Ethyl 7-phenylnorcaradiene-7-carboxylate
CAS Registry Number 33948-98-0
Comments SHIFTS OF VALENCE TAUTOMERS NORCARADIENE/CYCLOHEPTATRIENE SHIFTS OF C1,C6 ALSO MEASURED AT VARIABLE TEMPERATURE
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H16O2
InChI InChI=1S/C16H16O2/c1-2-18-15(17)16(12-8-4-3-5-9-12)13-10-6-7-11-14(13)16/h3-11,13-14H,2H2,1H3
InChIKey SZHMIFJETAFZRP-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference H. Guenther, W. Peters, Chem. Ber. 106, 3683 (1973).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CD2Cl2