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2-Cyclohexene-1,4-dione, 5,6-bis(1,1-dimethylethyl)-2-ethoxy-
SpectraBase Compound ID Eme2UiqpBrd
InChI InChI=1S/C16H26O3/c1-8-19-11-9-10(17)12(15(2,3)4)13(14(11)18)16(5,6)7/h9,12-13H,8H2,1-7H3
InChIKey OPHKYZVJHGRDLG-UHFFFAOYSA-N
Mol Weight 266.38 g/mol
Molecular Formula C16H26O3
Exact Mass 266.188195 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iade5HmoF2H
Name 2-Cyclohexene-1,4-dione, 5,6-bis(1,1-dimethylethyl)-2-ethoxy-
CAS Registry Number 65077-00-1
Comments Less than 3 mono-isotopic peaks
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Formula C16H26O3
InChI InChI=1S/C16H26O3/c1-8-19-11-9-10(17)12(15(2,3)4)13(14(11)18)16(5,6)7/h9,12-13H,8H2,1-7H3
InChIKey OPHKYZVJHGRDLG-UHFFFAOYSA-N
Molecular Weight 266.381 g/mol
SMILES C1(C=C(OCC)C(C(C1C(C)(C)C)C(C)(C)C)=O)=O
SPLASH splash10-0udi-0900000000-65c4e602d3bb65ec2152
Source of Spectrum SB-31-558-0
Synonyms 1-Ethoxy-4,5-di-t-butyl-cyclohex-1-enedi-3,6-one 5,6-ditert-butyl-2-ethoxy-2-cyclohexene-1,4-dione
Wiley ID 1270335