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4,8-Dimethyl-azulene

View entire compound with spectra: 2 NMR

4,8-Dimethyl-azulene
SpectraBase Compound ID 9BlTgBoVM9j
InChI InChI=1S/C12H12/c1-9-5-3-6-10(2)12-8-4-7-11(9)12/h3-8H,1-2H3
InChIKey YSKMWUCVEPTNQM-UHFFFAOYSA-N
Mol Weight 156.23 g/mol
Molecular Formula C12H12
Exact Mass 156.0939 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 95OrgUWQV7M
Name 4,8-Dimethyl-azulene
CAS Registry Number 7206-52-2
Comments AVERAGED C-H-COUPLING CONSTANTS REPORTED
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C12H12
InChI InChI=1S/C12H12/c1-9-5-3-6-10(2)12-8-4-7-11(9)12/h3-8H,1-2H3
InChIKey YSKMWUCVEPTNQM-UHFFFAOYSA-N
Instrument Name Varian XL-100
Literature Reference S. Braun, J. Kinkeldei, Tetrahedron 33, 1827 (1977).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3