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2,2,5-Trimethylcycloheptane-1,3-dione
SpectraBase Compound ID HdnZ0DnwISB
InChI InChI=1S/C10H16O2/c1-7-4-5-8(11)10(2,3)9(12)6-7/h7H,4-6H2,1-3H3
InChIKey AVRZKVUQKXUOQG-UHFFFAOYSA-N
Mol Weight 168.24 g/mol
Molecular Formula C10H16O2
Exact Mass 168.11503 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8q0MqPhWJVB
Name 2,2,5-Trimethylcycloheptane-1,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16O2
InChI InChI=1S/C10H16O2/c1-7-4-5-8(11)10(2,3)9(12)6-7/h7H,4-6H2,1-3H3
InChIKey AVRZKVUQKXUOQG-UHFFFAOYSA-N
Molecular Weight 168.236 g/mol
SMILES C1(C(C(CC(CC1)C)=O)(C)C)=O
SPLASH splash10-0103-9500000000-128f986085c6d5ebb432
Source of Spectrum K1-2000-1910-6
Synonyms 2,2,5-trimethyl-1,3-cycloheptanedione 2,2,5-trimethylcycloheptane-1,3-quinone
Wiley ID 750243