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1,3,5-Cycloheptatriene, 2,4-diethyl-7,7-dimethyl-
SpectraBase Compound ID INsogq6JjjJ
InChI InChI=1S/C13H20/c1-5-11-7-8-13(3,4)10-12(6-2)9-11/h7-10H,5-6H2,1-4H3
InChIKey RFZMTBDPUDVSAO-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 HynHBpaewLo
Name 1,3,5-CYCLOHEPTATRIENE, 2,4-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/c1-5-11-7-8-13(3,4)10-12(6-2)9-11/h7-10H,5-6H2,1-4H3
InChIKey RFZMTBDPUDVSAO-UHFFFAOYSA-N
Instrument Name CH7
Molecular Weight 176.1560
SMILES C=1C(C)(C)C=CC(CC)=CC1CC
SPLASH splash10-0002-3900000000-216cb24ff26aadac6bf1
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany