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5,7,7-Trimethyloxocan-2-one
SpectraBase Compound ID 9ECYPr33R2b
InChI InChI=1S/C10H18O2/c1-8-4-5-9(11)12-7-10(2,3)6-8/h8H,4-7H2,1-3H3
InChIKey BFPUARIQIFUEJO-UHFFFAOYSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2dJiYQEZYIV
Name 5,7,7-Trimethyloxocan-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-8-4-5-9(11)12-7-10(2,3)6-8/h8H,4-7H2,1-3H3
InChIKey BFPUARIQIFUEJO-UHFFFAOYSA-N
Molecular Weight 170.252 g/mol
SMILES C1(OCC(CC(CC1)C)(C)C)=O
SPLASH splash10-0002-9000000000-886a929fc3ab0d96b3e9
Source of Spectrum C-120-7477-8
Synonyms 5,7,7-trimethyl-2-oxocanone
Wiley ID 761011