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4,5-Oxepanedione, 3,3,6,6-tetramethyl-
SpectraBase Compound ID BCWRWPqQuDs
InChI InChI=1S/C10H16O3/c1-9(2)5-13-6-10(3,4)8(12)7(9)11/h5-6H2,1-4H3
InChIKey QRVXEZHTOOKHIF-UHFFFAOYSA-N
Mol Weight 184.23 g/mol
Molecular Formula C10H16O3
Exact Mass 184.109944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F9qKNsN9Lek
Name 4,5-Oxepanedione, 3,3,6,6-tetramethyl-
CAS Registry Number 42031-65-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O3
InChI InChI=1S/C10H16O3/c1-9(2)5-13-6-10(3,4)8(12)7(9)11/h5-6H2,1-4H3
InChIKey QRVXEZHTOOKHIF-UHFFFAOYSA-N
Molecular Weight 184.235 g/mol
SMILES C1(C(C(COCC1(C)C)(C)C)=O)=O
SPLASH splash10-0a4i-9200000000-36b85e191e7ee789c58c
Source of Spectrum J-8-4089-1
Synonyms 1,2-Cycloheptanedione, 5-oxa-3,3,7,7-tetramethyl- 3,3,6,6-tetramethyl-4,5-oxepanedione 3,3,6,6-tetramethyloxepane-4,5-dione 3,3,6,6-tetramethyloxepane-4,5-quinone
Wiley ID 1180558