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2,6-Cyclooctadien-1-one, 4-(1,1-dimethylethyl)-
SpectraBase Compound ID 2jriezy2Co3
InChI InChI=1S/C12H18O/c1-12(2,3)10-6-4-5-7-11(13)9-8-10/h4-5,8-10H,6-7H2,1-3H3/b5-4-,9-8-
InChIKey SWDNVOQEZORNQX-WPAMCMATSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IfCQY2hf2Im
Name 2,6-Cyclooctadien-1-one, 4-(1,1-dimethylethyl)-
CAS Registry Number 76794-07-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-12(2,3)10-6-4-5-7-11(13)9-8-10/h4-5,8-10H,6-7H2,1-3H3/b5-4-,9-8-
InChIKey SWDNVOQEZORNQX-WPAMCMATSA-N
Molecular Weight 178.275 g/mol
SMILES C1(\C=C/C(C\C=C/C1)C(C)(C)C)=O
SPLASH splash10-052f-9300000000-32ba2251443ac5a128a2
Source of Spectrum J-46-1982-0
Synonyms 4-tert-Butyl-2,6-cyclooctadien-1-one 4-tert-Butylcycloocta-2,6-dien-1-one
Wiley ID 1174600