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Bicyclo[4.1.0]hepta-1,3,5-triene
SpectraBase Compound ID 6ro9FpFpNT6
InChI InChI=1S/C7H6/c1-2-4-7-5-6(7)3-1/h1-4H,5H2
InChIKey AMSMVCOBCOZLEE-UHFFFAOYSA-N
Mol Weight 90.12 g/mol
Molecular Formula C7H6
Exact Mass 90.04695 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LtNhiai8ZmP
Name Benzocyclopropene
CAS Registry Number 4646-69-9
Comments J(C,C) FROM 2ND REFERENCE H.GUENTHER,W.HERRIG,J.AME
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C7H6
InChI InChI=1S/C7H6/c1-2-4-7-5-6(7)3-1/h1-4H,5H2
InChIKey AMSMVCOBCOZLEE-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference H. Guenther, G. Jikeli, H. Schmickler, Angew. Chem. 85, 826 (1973).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4