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2-tert-Butyl-5,5-dimethyl-1-phenyl-1,4-hexanedione

View entire compound with spectra: 1 MS (GC)

2-tert-Butyl-5,5-dimethyl-1-phenyl-1,4-hexanedione
SpectraBase Compound ID EHTJ6bym8KI
InChI InChI=1S/C18H26O2/c1-17(2,3)14(12-15(19)18(4,5)6)16(20)13-10-8-7-9-11-13/h7-11,14H,12H2,1-6H3
InChIKey HJEPIXWXGVWJPI-UHFFFAOYSA-N
Mol Weight 274.4 g/mol
Molecular Formula C18H26O2
Exact Mass 274.19328 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID L1tAKeJwK3b
Name 2-tert-Butyl-5,5-dimethyl-1-phenyl-1,4-hexanedione
CAS Registry Number 81096-47-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O2
InChI InChI=1S/C18H26O2/c1-17(2,3)14(12-15(19)18(4,5)6)16(20)13-10-8-7-9-11-13/h7-11,14H,12H2,1-6H3
InChIKey HJEPIXWXGVWJPI-UHFFFAOYSA-N
Molecular Weight 274.404 g/mol
SMILES C(C(=O)c1ccccc1)(CC(C(C)(C)C)=O)C(C)(C)C
SPLASH splash10-0a4i-9810000000-77fbaf683699b6e4ce9c
Source of Spectrum J-47-1883-0
Wiley ID 1278498