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1,3,5-Cycloheptatriene, 2,5-diethyl-7,7-dimethyl-
SpectraBase Compound ID DQmcn3ggB1g
InChI InChI=1S/C13H20/c1-5-11-7-8-12(6-2)10-13(3,4)9-11/h7-10H,5-6H2,1-4H3
InChIKey ZDBYOIQPGUIVTO-UHFFFAOYSA-N
Mol Weight 176.3 g/mol
Molecular Formula C13H20
Exact Mass 176.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4k2kuK8ZO4e
Name 1,3,5-CYCLOHEPTATRIENE, 2,5-DIETHYL-7,7-DIMETHYL-
Comments CYCLOHEPTATRIENE-NORCARADIENE EQULIBRIUM, VALENCE ISOMER
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C13H20
InChI InChI=1S/C13H20/c1-5-11-7-8-12(6-2)10-13(3,4)9-11/h7-10H,5-6H2,1-4H3
InChIKey ZDBYOIQPGUIVTO-UHFFFAOYSA-N
Instrument Name CH7
Molecular Weight 176.1560
SMILES C1(CC)=CC(C)(C)C=C(CC)C=C1
SPLASH splash10-01ot-3900000000-5ec182c468e46d382519
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany