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1,3,5-Cycloheptatriene, 3,4-dihexyl-7,7-dimethyl-

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1,3,5-Cycloheptatriene, 3,4-dihexyl-7,7-dimethyl-
SpectraBase Compound ID 40mpEbqNke8
InChI InChI=1S/C21H36/c1-5-7-9-11-13-19-15-17-21(3,4)18-16-20(19)14-12-10-8-6-2/h15-18H,5-14H2,1-4H3
InChIKey YJVFOEDRBHNLFF-UHFFFAOYSA-N
Mol Weight 288.5 g/mol
Molecular Formula C21H36
Exact Mass 288.281701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CNAF8VhsvA
Name 1,3,5-Cycloheptatriene, 3,4-dihexyl-7,7-dimethyl-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H36
InChI InChI=1S/C21H36/c1-5-7-9-11-13-19-15-17-21(3,4)18-16-20(19)14-12-10-8-6-2/h15-18H,5-14H2,1-4H3
InChIKey YJVFOEDRBHNLFF-UHFFFAOYSA-N
Molecular Weight 288.519 g/mol
SMILES C(CCCCC=1C=CC(C)(C)C=CC1CCCCCC)C
SPLASH splash10-015c-8970000000-d6985d11d405233b24a9
Synonyms 3,4-Dihexyl-7,7-dimethyl-1,3,5-cycloheptatriene 3,4-Dihexyl-7,7-dimethyl-cyclohepta-1,3,5-triene
Wiley ID 1493973