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2,6-Ditert-butyl-4-(dichloromethyl)-4-methyl-1-cyclohexa-2,5-dienone
SpectraBase Compound ID 33RqhVjYuhQ
InChI InChI=1S/C16H24Cl2O/c1-14(2,3)10-8-16(7,13(17)18)9-11(12(10)19)15(4,5)6/h8-9,13H,1-7H3
InChIKey LJEFTNVYDZZYTA-UHFFFAOYSA-N
Mol Weight 303.27 g/mol
Molecular Formula C16H24Cl2O
Exact Mass 302.120421 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8AHsxwNSAN2
Name 2,6-Ditert-butyl-4-(dichloromethyl)-4-methyl-1-cyclohexa-2,5-dienone
CAS Registry Number 54537-87-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H24Cl2O
InChI InChI=1S/C16H24Cl2O/c1-14(2,3)10-8-16(7,13(17)18)9-11(12(10)19)15(4,5)6/h8-9,13H,1-7H3
InChIKey LJEFTNVYDZZYTA-UHFFFAOYSA-N
Molecular Weight 303.273 g/mol
SMILES C=1(C(C(C(C)(C)C)=CC(C1)(C(Cl)Cl)C)=O)C(C)(C)C
SPLASH splash10-0a4i-9020000000-aedd7cea82b736f853f6
Source of Spectrum F-43-510-0
Synonyms 2,6-Ditert-butyl-4-(dichloromethyl)-4-methyl-cyclohexa-2,5-dien-1-one 4-[bis(chloranyl)methyl]-2,6-ditert-butyl-4-methyl-cyclohexa-2,5-dien-1-one
Wiley ID 1304584